SCHEMBL8922691

SCHEMBL8922691

Cc1ccc(NC(=O)NC2CC(c3cccc(N(C)C)c3)c3ccccc3N(CC(=O)NC(C)(C)C)C2=O)cc1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.81

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
SCHEMBL8922697 0.93 CCKBR (0.84) CCKBR
SCHEMBL8920148 0.93 CCKBR (0.78) CCKBR
SCHEMBL8920896 0.90 CCKBR (0.81) CCKBR
SCHEMBL8921231 0.90 CCKBR (1.00) CCKBR
SCHEMBL8923762 0.89 CCKBR (0.87) CCKBR
SCHEMBL8919483 0.89 CCKBR (0.84) CCKBR
SCHEMBL8920664 0.89 CCKBR (0.95) CCKBR
SCHEMBL8920328 0.89 CCKBR (0.82) CCKBR
SCHEMBL8920296 0.88 CCKBR (0.81) CCKBR
SCHEMBL8920838 0.88 CCKBR (0.83) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643904-A Substituted hexahdryoazepinones and tetrahydrobenzazepinones PFIZER INC. (US) 1997-07-01 US disclosed
WO-1993015059-A1 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS PFIZER INC. (US) 1993-08-05 WO disclosed