SCHEMBL7955437

SCHEMBL7955437

CCc1cccc2c1N(CC(=O)N1CC3CCC(CC3)C1)C(=O)[C@H](NC(=O)Nc1cccc(-c3nnn[nH]3)c1)C=C2c1ccccc1F

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.62
CCKAR P32238 1/20 0.40

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
SCHEMBL7955432 0.88 CCKBR (0.80) CCKBRCCKAR
SCHEMBL7551422 0.86 CCKBR (0.65) CCKBRCCKAR
SCHEMBL7547102 0.81 CCKBR (0.79) CCKBRCCKAR
SCHEMBL7547144 0.81 CCKBR (0.79) CCKBRCCKAR
SCHEMBL7545628 0.81 CCKBR (0.79) CCKBRCCKAR
SCHEMBL7550681 0.80 CCKBR (0.70) CCKBRCCKAR
SCHEMBL7599150 0.80 CCKBR (0.70) CCKBRCCKAR
SCHEMBL7550105 0.79 CCKBR (0.80) CCKBRCCKAR
SCHEMBL7550097 0.79 CCKBR (0.80) CCKBRCCKAR
SCHEMBL9056049 0.79 CCKBR (0.79) CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291452-B1 CHOLECYSTOKININ ANTAGONISTS. FUJISAWA PHARMACETICAL CO., LTD. (JP) 2001-09-18 US disclosed
EP-0934282-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 EP disclosed
WO-1998015535-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-04-16 WO disclosed