SCHEMBL602244

SCHEMBL602244

c1ccc2c(c1)[nH]c1cnncc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
GPR3 P46089 1/20 0.64
HSD17B10 Q99714 1/20 0.64
GABRP O00591 7/20 0.61
GABRD O14764 7/20 0.61
GABRA1 P14867 7/20 0.61
GABRB1 P18505 7/20 0.61
GABRG2 P18507 7/20 0.61
GABRB3 P28472 7/20 0.61
GABRA5 P31644 7/20 0.61
GABRA3 P34903 7/20 0.61
GABRA2 P47869 7/20 0.61
GABRB2 P47870 7/20 0.61
GABRA4 P48169 7/20 0.61
GABRE P78334 7/20 0.61
GABRA6 Q16445 7/20 0.61
GABRG1 Q8N1C3 7/20 0.61
GABRG3 Q99928 7/20 0.61
GABRQ Q9UN88 7/20 0.61
KDM4E B2RXH2 2/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Carbazole SCHEMBL30209164 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL29355407 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL370524 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL29627417 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL30761795 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL26134117 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL7650 0.80 ALDH1A1 (1.00) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL23148507 0.77 ALDH1A1 (0.93) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL25327723 0.77 ALDH1A1 (0.93) ALDH1A1GPR3HSD17B10GABRPGABRD
Carbazole SCHEMBL23782006 0.77 ALDH1A1 (0.93) ALDH1A1GPR3HSD17B10GABRPGABRD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 53 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910379-B1 CASPASE INHIBITOR PRODRUGS VERTEX PHARMA (US) 2011-10-19 EP claimed
US-20110144074-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-16 US claimed
US-7879891-B2 such as (S)-Carbazole-9-carboxylic acid 1-(3a-fluoromethyl-5-oxo-3a,5,6,6a-tetrahydro-furo[3,2-d]oxazol-2-yl)-2-methyl-propyl ester, used for the treatment of diseases related to inflammatory or degenerative conditions VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-02-01 US claimed
US-20090215736-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS, INCORPORATED (US) 2009-08-27 US claimed
US-7442790-B2 Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS, INCORPORATED (US) 2008-10-28 US claimed
EP-1923386-A2 Carbamate caspase inhibitors and uses thereof Vertex Pharmceuticals Incorporated (US) 2008-05-21 EP claimed
EP-1910379-A2 CASPASE INHIBITOR PRODRUGS Vertex Pharmaceuticals Incorporated (US) 2008-04-16 EP claimed
EP-1268425-B1 CARBAMATE CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMA (US) 2008-01-23 EP claimed
US-20080015172-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 US claimed
US-20070155718-A1 Caspase inhibitor prodrugs VERTEX PHARMACEUTICALS INCORPORATED 2007-07-05 US claimed
WO-2007015931-A2 CASPASE INHIBITOR PRODRUGS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-02-08 WO claimed
US-7074782-B2 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-07-11 US claimed
US-20040053920-A1 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2004-03-18 US claimed
EP-1392289-A2 CASPASE INHIBITORS AND USES THEREOF Vertex Pharmaceuticals Incorporated (US) 2004-03-03 EP claimed
US-20030092703-A1 Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2003-05-15 US claimed
EP-1268425-A2 CARBAMATE CASPASE INHIBITORS AND USES THEREOF Vertex Pharmaceuticals Incorporated (US) 2003-01-02 EP claimed
WO-2002094263-A2 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2002-11-28 WO claimed
US-20020028803-A1 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2002-03-07 US claimed
WO-2001072707-A2 CARBAMATE CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-10-04 WO claimed
US-10391175-B2 BET bromodomain inhibitors and therapeutic methods using the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-08-27 US disclosed
EP-2970312-B1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME UNIV MICHIGAN REGENTS (US) 2017-11-15 EP disclosed
US-20170281773-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-10-05 US disclosed
US-9675697-B2 BET bromodomain inhibitors and therapeutic methods using the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-06-13 US disclosed
US-20170160287-A1 USE OF 7-CHLORO-N,N,5-TRIMETHYL-4-OXO-3-PHENYL-3,5-DIHYDRO-4H-PYRIDAZINO[4,5-B] INDOLE-1-ACETAMIDE AS A BIOMARKER OF PERIPHERAL BENZODIAZEPINE RECEPTOR LEVELS SANOFI (FR) 2017-06-08 US disclosed
EP-2970312-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME The Regents of The University of Michigan (US) 2016-01-20 EP disclosed
WO-2014164596-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-09 WO disclosed
US-20140256706-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-09-11 US disclosed
EP-2349352-B1 Use of 7-chloro-N,N,5-trimethyl-4-oxo-3-phenyl-3,5-dihydro-4H-pyridazino[4,5-b]indole-1-acetamide as a biomarker of peripheral benzodiazepine receptor levels SANOFI SA (FR) 2013-12-25 EP disclosed
US-8168798-B2 Caspase inhibitor prodrugs VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-01 US disclosed
US-20120039816-A1 USE OF 7-CHLORO-N,N,5-TRIMETHYL-4-OXO-3-PHENYL-3,5-DIHYDRO-4H-PYRIDAZINO[4,5-B] INDOLE-1-ACETAMIDE AS A BIOMARKER OF PERIPHERAL BENZODIAZEPINE RECEPTOR LEVELS SANOFI-AVENTIS (FR) 2012-02-16 US disclosed
EP-1910379-B1 CASPASE INHIBITOR PRODRUGS VERTEX PHARMA (US) 2011-10-19 EP disclosed
US-20110144074-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-16 US disclosed
US-20110137037-A1 CASPASE INHIBITOR PRODRUGS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-09 US disclosed
US-7879891-B2 such as (S)-Carbazole-9-carboxylic acid 1-(3a-fluoromethyl-5-oxo-3a,5,6,6a-tetrahydro-furo[3,2-d]oxazol-2-yl)-2-methyl-propyl ester, used for the treatment of diseases related to inflammatory or degenerative conditions VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-02-01 US disclosed
US-7875712-B2 inhibitors of apoptosis and IL-1 beta secretion; mediate cell apoptosis and inflammation; good cell penetration and pharmacokinetic properties; [3S/R(2S)]3-[2-(Carbazol-9-yl-2-oxo-ethyl)-pentanoylamino]-5-fluoro-4-oxo-pentanoic acid VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-25 US disclosed
EP-2181717-A1 Use of 7-chloro-N,N,5-trimethyl-4-oxo-3-phenyl-3,5-dihydro-4H-pyridazino[4,5-B]indole-1-acetamide as a biomarker of peripheral benzodiazepine receptor levels Sanofi-Aventis (FR) 2010-05-05 EP disclosed
US-20090215736-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS, INCORPORATED (US) 2009-08-27 US disclosed
US-7442790-B2 Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS, INCORPORATED (US) 2008-10-28 US disclosed
EP-1923386-A2 Carbamate caspase inhibitors and uses thereof Vertex Pharmceuticals Incorporated (US) 2008-05-21 EP disclosed
US-7351702-B2 Controlling apoptosis; antiinflammatory agents; autoimmune disease VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-01 US disclosed
EP-1268425-B1 CARBAMATE CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMA (US) 2008-01-23 EP disclosed
EP-1268425-B1 CARBAMATE CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMA (US) 2008-01-23 EP disclosed
US-20080015172-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 US disclosed
US-20070155718-A1 Caspase inhibitor prodrugs VERTEX PHARMACEUTICALS INCORPORATED 2007-07-05 US disclosed
US-7074782-B2 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-07-11 US disclosed
US-20040053920-A1 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2004-03-18 US disclosed
US-6689784-B2 CONTROLLING CELL APOPTOSIS VERTEX PHARMACEUTICALS INCORPORATED 2004-02-10 US disclosed
US-20030092703-A1 Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2003-05-15 US disclosed
EP-1268425-A2 CARBAMATE CASPASE INHIBITORS AND USES THEREOF Vertex Pharmaceuticals Incorporated (US) 2003-01-02 EP disclosed
US-20020028803-A1 Carbamate caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED 2002-03-07 US disclosed
WO-2001072707-A2 CARBAMATE CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-10-04 WO disclosed
US-5652239-A TREATMENT OF STROKES, ISCHEMIC ATTACK, ANTAGONISTS OF EXCITATORY AMINO ACIDS GLUTAMATE AND ASPARTATE IMPERIAL CHEMICAL COMPANY (GB) 1997-07-29 US disclosed
EP-0512817-A1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LIMITED (GB) 1992-11-11 EP disclosed
EP-0512817-A1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LIMITED (GB) 1992-11-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020028803-A1 Carbamate caspase inhibitors and uses thereof CASP1, CASP2, CASP3 ALDH1A1 1692/4885GPR3 1827/4885HSD17B10 705/4885
US-20070155718-A1 Caspase inhibitor prodrugs CASP1, CASP5, CASP2 ALDH1A1 757/4885GPR3 2517/4885HSD17B10 897/4885
US-10391175-B2 BET bromodomain inhibitors and therapeutic methods using the same BRD4, BRDT, BRD3 ALDH1A1 4162/4885GPR3 3937/4885HSD17B10 2887/4885
US-20080015172-A1 CASPASE INHIBITORS AND USES THEREOF CASP1, CASP2, CASP9 ALDH1A1 1417/4885GPR3 1851/4885HSD17B10 526/4885
US-20110144074-A1 CASPASE INHIBITORS AND USES THEREOF CASP1, CASP2, CASP9 ALDH1A1 1317/4885GPR3 1923/4885HSD17B10 389/4885
US-20040053920-A1 Carbamate caspase inhibitors and uses thereof CASP1, CASP2, CASP3 ALDH1A1 1692/4885GPR3 1827/4885HSD17B10 705/4885
US-20110137037-A1 CASPASE INHIBITOR PRODRUGS CASP1, CASP5, CASP2 ALDH1A1 757/4885GPR3 2517/4885HSD17B10 897/4885
US-20170281773-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME BRD4, BRDT, BRD3 ALDH1A1 4162/4885GPR3 3937/4885HSD17B10 2887/4885
US-20090215736-A1 CASPASE INHIBITORS AND USES THEREOF CASP1, CASP2, CASP9 ALDH1A1 1317/4885GPR3 1923/4885HSD17B10 389/4885
US-20140256706-A1 BET BROMODOMAIN INHIBITORS AND THERAPEUTIC METHODS USING THE SAME BRD4, BRDT, BRD3 ALDH1A1 4162/4885GPR3 3937/4885HSD17B10 2887/4885
US-20030092703-A1 Caspase inhibitors and uses thereof CASP1, CASP2, CASP3 ALDH1A1 802/4885GPR3 2298/4885HSD17B10 372/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.