SCHEMBL8403235

SCHEMBL8403235

COC(=O)c1cccc(N(C(N)=O)C2CC(c3ccccc3)c3ccc(C)cc3N(CC(N)=O)C2=O)c1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 19/20 0.52
GSK3B P49841 1/20 0.36

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
SCHEMBL8404667 0.92 CCKBR (0.49) CCKBR
SCHEMBL8402155 0.91 CCKBR (0.65) CCKBR
SCHEMBL8402077 0.84 CCKBR (0.64) CCKBR
SCHEMBL8402133 0.82 CCKBR (0.41) CCKBR
SCHEMBL8920118 0.82 CCKBR (0.57) CCKBR
SCHEMBL8402188 0.82 CCKBR (0.40) CCKBR
SCHEMBL8402172 0.81 CCKBR (0.41) CCKBR
SCHEMBL8398505 0.80 CCKBR (0.41) CCKBR
SCHEMBL8403246 0.80 CCKBR (0.43) CCKBR
SCHEMBL8401373 0.80 CCKBR (0.42) 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
EP-0711283-B1 TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS PFIZER (US) 1999-06-16 EP disclosed
US-5618811-A Tetrahydro-1H-benzazepinones and hexahydroazepinones as selective cholecystokinin-B receptor antagonists PFIZER INC. (US) 1997-04-08 US disclosed