SCHEMBL8922790

SCHEMBL8922790

CC(=O)N(N1C(=O)C(NC(=O)Nc2cccc(C)c2)CC(c2ccccc2)CC1c1ccc(Cl)cc1)C(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.62

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
SCHEMBL8921287 0.95 CCKBR (0.68) CCKBR
SCHEMBL8919350 0.95 CCKBR (0.65) CCKBR
SCHEMBL8922639 0.93 CCKBR (0.69) CCKBR
SCHEMBL8922258 0.93 CCKBR (0.58) CCKBR
SCHEMBL9366893 0.93 CCKBR (0.58) CCKBR
SCHEMBL8922824 0.93 CCKBR (0.66) CCKBR
SCHEMBL8919470 0.92 CCKBR (0.59) CCKBR
SCHEMBL8919276 0.91 CCKBR (0.54) CCKBR
SCHEMBL8920913 0.91 CCKBR (0.60) CCKBR
SCHEMBL8920177 0.90 CCKBR (0.55) 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
US-5484917-A FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY PFIZER INC. (US) 1996-01-16 US disclosed