SCHEMBL6180598

SCHEMBL6180598

Cc1ccccc1C(=O)CN1C(=O)C(NC(=O)OC(C)(C)C)CN(C(=O)c2ccc(Cl)cc2)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XIAP P98170 16/20 0.48
CCKBR P32239 1/20 0.43

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
SCHEMBL6180634 0.93 XIAP (0.43) XIAP
SCHEMBL6179477 0.87 XIAP (0.44) XIAPCCKBR
SCHEMBL6176902 0.86 XIAP (0.46) XIAPCCKBR
SCHEMBL6177572 0.86 SCN9A (0.40) CCKBR
SCHEMBL6177504 0.86 CCKBR (0.39) XIAPCCKBR
SCHEMBL6180586 0.85 XIAP (0.39) XIAPCCKBR
SCHEMBL6178704 0.85 SCN9A (0.41) XIAP
SCHEMBL6177871 0.85 ACE (0.39) CCKBR
SCHEMBL6178130 0.85 XIAP (0.43) XIAP
SCHEMBL6178654 0.84 XIAP (0.42) XIAPCCKBR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945445-B9 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2005-12-28 EP disclosed
EP-0945445-B1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-09-03 EP disclosed
US-6239131-B1 WHICH HAVE GASTRIN AND/OR CCK-B (CHOLECYSTOKININ-B) RECEPTOR ANTAGONISM, USEFUL AS REMEDIES FOR GASTRIC ULCER AND GASTROINTESTINAL MOVEMENT DISORDER. ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-05-29 US disclosed
EP-0945445-A1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed