SCHEMBL6176388

SCHEMBL6176388

Cc1ccc2c(c1)N(CC(=O)c1cccs1)C(=O)C(NC(=O)Nc1cccc(C(=O)OC(C)(C)C)c1)CN2C(=O)CC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.46

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
SCHEMBL6179807 0.92 CCKBR (0.51) CCKBR
SCHEMBL6175760 0.90 CCKBR (0.41) CCKBR
SCHEMBL6177162 0.88 CCKBR (0.45) CCKBR
SCHEMBL6176679 0.86 CCKBR (0.46) CCKBR
SCHEMBL6177683 0.86 CCKBR (0.36) CCKBR
SCHEMBL6177998 0.86 CCKBR (0.47) CCKBR
SCHEMBL6176746 0.85 CCKBR (0.52) CCKBR
SCHEMBL6178302 0.85 CCKBR (0.39) CCKBR
SCHEMBL6178050 0.83 CCKBR (0.50) CCKBR
SCHEMBL6179769 0.81 CCKBR (0.48) CCKBR

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