SCHEMBL397270

SCHEMBL397270

Nc1ccccc1-c1ccco1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TAAR1 Q96RJ0 1/20 0.48
HSD17B10 Q99714 5/20 0.44
MAPT P10636 5/20 0.44
ADORA2A P29274 5/20 0.44
POLB P06746 4/20 0.44
KDM4E B2RXH2 4/20 0.44
BLM P54132 4/20 0.44
ADORA1 P30542 4/20 0.44
MEN1 O00255 3/20 0.44
HPGD P15428 3/20 0.44
ALOX15 P16050 3/20 0.44
CASP1 P29466 3/20 0.44
CASP7 P55210 3/20 0.44
KMT2A Q03164 3/20 0.44
USP2 O75604 2/20 0.44
ESR1 P03372 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL29634306 1.00 ALDH1A1 (0.52) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL2008325 0.88 TAAR1 (0.45) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL13030880 0.79 CFTR (0.43) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL16600588 0.79 TAAR1 (0.50) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL6873928 0.77 TAAR1 (0.53) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL7807450 0.77 TAAR1 (0.53) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
Hydrochloric Acid SCHEMBL7807700 0.75 TAAR1 (0.52) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT
SCHEMBL19199419 0.75 ADORA2A (0.49) ALDH1A1TAAR1HSD17B10MAPTADORA2A
SCHEMBL22897894 0.75 ADORA2A (0.49) ALDH1A1TAAR1HSD17B10MAPTADORA2A
SCHEMBL11398832 0.74 ALDH1A1 (0.44) ALDH1A1L3MBTL1TAAR1HSD17B10MAPT

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 106 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807406-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-18 EP claimed
WO-2006047503-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA (BE) 2006-05-04 WO claimed
US-20050113566-A1 Inhibitors of C-FMS kinase JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US claimed
US-20230192613-A1 Charged Ion Channel Blockers and Methods for Use NOCION THERAPEUTICS INC (US) 2023-06-22 US disclosed
US-11136338-B2 Fused thiazolopyrimidine derivatives as MNKs inhibitors LIFEARC (GB) 2021-10-05 US disclosed
EP-3705477-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vertex Pharmaceuticals Incorporated (US) 2020-09-09 EP disclosed
US-20200247822-A1 Fused Thiazolopyrimidine Derivatives As MNKS Inhibitors ASTRAZENECA UK LIMITED (GB) 2020-08-06 US disclosed
US-10669284-B2 Fused thiazolopyrimidine derivatives as MNKS inhibitors LIFEARC (GB) 2020-06-02 US disclosed
US-10662192-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-05-26 US disclosed
EP-3216787-B1 INTERMEDIATES FOR THE PREPARATION OF MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2020-02-19 EP disclosed
US-20190144450-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-05-16 US disclosed
US-20040235927-A1 Synthesis and antimicrobial activity of novel dicationic \"reversed amidines\ NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-11-25 US disclosed
WO-2004085433-A2 POSITIVE ALLOSTERIC MODULATORS OF THE NICOTINIC ACETYLCHOLINE RECEPTOR PHARMACIA & UPJOHN COMPANY LLC (US) 2004-10-07 WO disclosed
US-20040106613-A1 Sulfonamides as potassium channel blockers ICAGEN, INC. 2004-06-03 US disclosed
WO-2004016221-A2 SULFONAMIDES AS POTASSIUM CHANNEL BLOCKERS ICAGEN, INC (US) 2004-02-26 WO disclosed
EP-1337510-A2 SYNTHESIS AND ANTIMICROBIAL ACTIVITYOF NOVEL DICATIONIC \"REVERSED AMIDINES\ UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2003-08-27 EP disclosed
US-20030083362-A1 Synthesis and antimicrobial activity of novel dicationic\"reversed amidines\ GEORGIA STATE UNIVERSITY 2003-05-01 US disclosed
WO-2002057224-A2 SYNTHESIS AND ANTIMICROBIAL ACTIVITYOF NOVEL DICATIONIC 'REVERSED AMIDINES' UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2002-07-25 WO disclosed
EP-1175406-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2002-01-30 EP disclosed
WO-2000066563-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2000-11-09 WO 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 (10 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-20190144450-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 ALDH1A1 2165/4885L3MBTL1 3552/4885TAAR1 3507/4885
US-20030083362-A1 Synthesis and antimicrobial activity of novel dicationic\"reversed amidines\ HRH4, TLR7, DDAH1 ALDH1A1 3348/4885L3MBTL1 3023/4885TAAR1 1204/4885
US-20040235927-A1 Synthesis and antimicrobial activity of novel dicationic \"reversed amidines\ HRH4, HDHD5, MRPS7 ALDH1A1 3425/4885L3MBTL1 2435/4885TAAR1 1320/4885
US-10662192-B2 Modulators of ATP-binding cassette transporters CFTR, ABCB1, ABCC2 ALDH1A1 2165/4885L3MBTL1 3552/4885TAAR1 3507/4885
US-20200247822-A1 Fused Thiazolopyrimidine Derivatives As MNKS Inhibitors MAPT, TTBK1, TTBK2 ALDH1A1 3442/4885L3MBTL1 4412/4885TAAR1 4130/4885
US-20040106613-A1 Sulfonamides as potassium channel blockers KCNJ2, KCNJ1, KCNJ11 ALDH1A1 3030/4885L3MBTL1 4572/4885TAAR1 4362/4885
US-20230192613-A1 Charged Ion Channel Blockers and Methods for Use TRPV1, TRPV2, TRPV5 ALDH1A1 2736/4885L3MBTL1 4844/4885TAAR1 929/4885
US-11136338-B2 Fused thiazolopyrimidine derivatives as MNKs inhibitors MAPT, TTBK1, TTBK2 ALDH1A1 3442/4885L3MBTL1 4412/4885TAAR1 4130/4885
US-20050113566-A1 Inhibitors of C-FMS kinase ALK, TYRO3, PDGFRB ALDH1A1 2507/4885L3MBTL1 2517/4885TAAR1 474/4885
US-10669284-B2 Fused thiazolopyrimidine derivatives as MNKS inhibitors MAPT, TTBK1, TTBK2 ALDH1A1 3501/4885L3MBTL1 4413/4885TAAR1 4178/4885

“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.