SCHEMBL8922075

SCHEMBL8922075

Cc1cccc(N(C(N)=O)C2CC(c3ccccc3)c3ccc(Cl)cc3N(CC(=O)NC(C)(C)C)C2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.58

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
SCHEMBL8920708 0.95 CCKBR (0.58) CCKBR
SCHEMBL8920118 0.94 CCKBR (0.57) CCKBR
SCHEMBL8921845 0.92 CCKBR (0.55) CCKBR
SCHEMBL8923749 0.92 CCKBR (0.59) CCKBR
SCHEMBL8924316 0.91 CCKBR (0.53) CCKBR
SCHEMBL8921110 0.90 CCKBR (0.56) CCKBR
SCHEMBL8919553 0.90 CCKBR (0.55) CCKBR
SCHEMBL8921630 0.90 CCKBR (0.54) CCKBR
SCHEMBL8921091 0.90 CCKBR (0.52) CCKBR
SCHEMBL8920495 0.89 CCKBR (0.51) 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