SCHEMBL1740329

SCHEMBL1740329

O=C(NC1(C(=O)O)CC1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.53
FAAH O00519 1/20 0.51
MAPK1 P28482 1/20 0.51
CYP2C19 P33261 1/20 0.51
CTSK P43235 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
APAF1 O14727 1/20 0.49
TDP2 O95551 1/20 0.49
NSD2 O96028 1/20 0.49
ALDH1A1 P00352 1/20 0.49
ABL1 P00519 1/20 0.49
HSP90AA1 P07900 1/20 0.49
HSP90AB1 P08238 1/20 0.49
MAPT P10636 1/20 0.49
CASP3 P42574 1/20 0.49
HTT P42858 1/20 0.49
GALK1 P51570 1/20 0.49
BLM P54132 1/20 0.49
PPP1CA P62136 1/20 0.49

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
SCHEMBL1836676 0.91 CTSK (0.61) CTSLFAAHMAPK1CYP2C19CTSK
SCHEMBL13804119 0.85 CTSL (0.52) CTSLFAAHMAPK1CYP2C19CTSK
SCHEMBL1740298 0.83 KCNK3 (0.46) KDM4EMEN1KMT2AKCNK3KCNK9
SCHEMBL1976526 0.83 KDM4E (0.48) KDM4EMEN1ALDH1A1MAPTHTT
SCHEMBL1560542 0.83 CXCR5 (0.61) CXCR5
SCHEMBL28624943 0.82 KDM4E (0.54) MAPK1KDM4EMEN1ALDH1A1MAPT
SCHEMBL1813782 0.81 CTSL (0.64) CTSLCTSKMEN1KMT2AHDAC1
SCHEMBL18059064 0.79 CTSL (0.60) CTSLFAAHCTSKKDM4EMEN1
SCHEMBL1912242 0.79 CTSL (0.49) CTSLCTSKMEN1ALDH1A1MAPT
SCHEMBL1186231 0.78 CTSL (0.57) CTSLFAAHMAPK1CYP2C19CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2225238-B1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZOÝ1,2- ¨IMIDAZOLE-3- CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INT (DE) 2014-09-03 EP disclosed
EP-2509981-B1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE LILLY CO ELI (US) 2014-08-06 EP disclosed
EP-2509981-B1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE LILLY CO ELI (US) 2014-08-06 EP disclosed
CN-101889011-B Derivatives of 6,7-dihydro-5h-imidazo[1,2-a]imidazole-3- carboxylic acid amides BOEHRINGER INGELHEIM INT 2014-05-28 CN disclosed
US-8552205-B2 Derivatives of 6,7-dihydro-5H-imidazo[1,2-alpha]imidazole-3-carboxylic acid amides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-08 US disclosed
US-8299061-B2 Inhibitors of diacylglycerol acyltransferase ELI LILLY AND COMPANY (US) 2012-10-30 US disclosed
US-8299061-B2 Inhibitors of diacylglycerol acyltransferase ELI LILLY AND COMPANY (US) 2012-10-30 US disclosed
US-20110319396-A1 BENZODIAZEPIN-2-ON DERIVATIVES MSD K.K. (JP) 2011-12-29 US disclosed
EP-2389366-A1 BENZODIAZEPIN-2-ON DERIVATIVES MSD K.K. (JP) 2011-11-30 EP disclosed
US-8040502-B2 Optical inspection of flat media using direct image technology WDI WISE DEVICE INC. (CA) 2011-10-18 US disclosed
CN-101889011-A Derivatives of 6,7-dihydro-5h-imidazo[1,2-a]imidazole-3- carboxylic acid amides BOEHRINGER INGELHEIM INT 2010-11-17 CN disclosed
EP-2225238-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZOÝ1,2- ¨IMIDAZOLE-3- CARBOXYLIC ACID AMIDES Boehringer Ingelheim International GmbH (DE) 2010-09-08 EP disclosed
WO-2010084979-A1 BENZODIAZEPIN-2-ON DERIVATIVES BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-07-29 WO disclosed
WO-2009070485-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-α]IMIDAZOLE-3- CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-06-04 WO disclosed
US-4570014-A Cycloalkanecarboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1986-02-11 US disclosed
US-4554017-A Method and compositions for regulating plant growth using cycloalkane-carboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-11-19 US disclosed
EP-0073391-B1 METAL COMPLEXES OF 1-AMINOCYCLOPROPANE-CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PLANT GROWTH REGULATORS BAYER AG (DE) 1985-03-06 EP disclosed
US-4494982-A Plant growth-regulating 1-amino-cyclopropanecarboxylic acid metal complexes BAYER AKTIENGESELLSCHAFT (DE) 1985-01-22 US disclosed
US-4457870-A CHELATE COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1984-07-03 US disclosed
EP-0073391-A1 Metal complexes of 1-aminocyclopropane-carboxylic acids, process for their preparation and their use as plant growth regulators BAYER AG (DE) 1983-03-09 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 (1 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-20110319396-A1 BENZODIAZEPIN-2-ON DERIVATIVES DGAT1, DGAT2, GRIN1 CTSL 4798/4885FAAH 1934/4885MAPK1 1869/4885

“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.