SCHEMBL8922156

SCHEMBL8922156

CCC(C)(C)NC(=O)CN1C(=O)C(NC(=O)Nc2cccc(C)c2)CC(c2ccc(C)cc2)c2ccccc21

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.80

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
SCHEMBL8921668 0.95 CCKBR (0.76) CCKBR
SCHEMBL8921819 0.95 CCKBR (0.82) CCKBR
SCHEMBL8920674 0.93 CCKBR (0.92) CCKBR
SCHEMBL8922152 0.93 CCKBR (0.81) CCKBR
SCHEMBL8920515 0.92 CCKBR (0.78) CCKBR
SCHEMBL8921764 0.91 CCKBR (0.77) CCKBR
SCHEMBL8921665 0.90 CCKBR (0.72) CCKBR
SCHEMBL8921814 0.89 CCKBR (0.77) CCKBR
SCHEMBL8920529 0.89 CCKBR (1.00) CCKBR
SCHEMBL8921857 0.88 CCKBR (0.88) 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 3 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
US-5484917-A FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY PFIZER INC. (US) 1996-01-16 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