SCHEMBL8922067

SCHEMBL8922067

Cc1cccc(N(C(N)=O)C2CC(c3ccccc3)CC(Cc3ccccc3)N(CC(=O)OC(C)(C)C)C2=O)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.43
PLA2G5 P39877 1/20 0.43
CCKBR P32239 13/20 0.40
DPP4 P27487 1/20 0.34
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
CETP P11597 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL8921199 0.91 PLA2G10 (0.42) PLA2G10PLA2G5CCKBRCETP
SCHEMBL8923398 0.91 PLA2G10 (0.42) PLA2G10PLA2G5CCKBRCETP
SCHEMBL8920178 0.89 CCKBR (0.46) PLA2G10PLA2G5CCKBR
SCHEMBL8921138 0.88 PLA2G10 (0.45) PLA2G10PLA2G5CCKBRDPP4ALOX15
SCHEMBL8924391 0.88 CCKBR (0.39) PLA2G10PLA2G5CCKBR
SCHEMBL8920820 0.84 CCKBR (0.40) PLA2G10PLA2G5CCKBR
SCHEMBL8920349 0.82 RAMP1 (0.42) PLA2G10PLA2G5CCKBRALOX15
SCHEMBL8923886 0.80 CCKBR (0.42) PLA2G10PLA2G5CCKBR
SCHEMBL8922606 0.80 CCKBR (0.40) PLA2G10PLA2G5CCKBR
SCHEMBL8922070 0.78 CCKBR (0.62) 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