SCHEMBL8922705

SCHEMBL8922705

CC(=O)Nc1cccc(NC(=O)NC2CC(c3ccccc3)CC(c3ccccc3)N(N(C(C)=O)C(C)(C)C)C2=O)c1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.55

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
SCHEMBL8919350 0.92 CCKBR (0.65) CCKBR
SCHEMBL8919276 0.91 CCKBR (0.54) CCKBR
SCHEMBL8919641 0.91 CCKBR (0.53) CCKBR
SCHEMBL8920360 0.91 CCKBR (0.53) CCKBR
SCHEMBL8922358 0.91 CCKBR (0.53) CCKBR
SCHEMBL8921287 0.91 CCKBR (0.68) CCKBR
SCHEMBL8919407 0.90 CCKBR (0.53) CCKBR
SCHEMBL8923534 0.90 CCKBR (0.57) CCKBR
SCHEMBL8920585 0.90 CCKBR (0.54) CCKBR
SCHEMBL8922824 0.90 CCKBR (0.66) 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