SCHEMBL8923886

SCHEMBL8923886

CC(C)(C)OC(=O)CN1C(=O)C(N(C(N)=O)c2cccc(Cl)c2)CC(c2ccccc2)CC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 12/20 0.42
PLA2G10 O15496 1/20 0.38
PLA2G5 P39877 1/20 0.38
TP53 P04637 4/20 0.37
MDM2 Q00987 4/20 0.37
RAMP1 O60894 3/20 0.36
CALCRL Q16602 3/20 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
SCHEMBL8920178 0.91 CCKBR (0.46) CCKBRPLA2G10PLA2G5
SCHEMBL8921722 0.90 RAMP1 (0.41) CCKBRPLA2G10PLA2G5TP53MDM2
SCHEMBL8921199 0.90 PLA2G10 (0.42) CCKBRPLA2G10PLA2G5TP53MDM2
SCHEMBL8922606 0.89 CCKBR (0.40) CCKBRPLA2G10PLA2G5RAMP1CALCRL
SCHEMBL8919257 0.86 CCKBR (0.53) CCKBR
SCHEMBL8922132 0.84 CCKBR (0.34) CCKBRTP53MDM2
SCHEMBL9365635 0.81 CCKBR (0.37) CCKBR
SCHEMBL8919265 0.81 CCKBR (0.38) CCKBR
SCHEMBL8922067 0.80 PLA2G10 (0.43) CCKBRPLA2G10PLA2G5
SCHEMBL8920349 0.80 RAMP1 (0.42) CCKBRPLA2G10PLA2G5TP53RAMP1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625145-A1 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS PFIZER INC. (US) 1994-11-23 EP claimed
WO-1993015059-A1 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS PFIZER INC. (US) 1993-08-05 WO claimed
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
EP-0625145-A1 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS PFIZER INC. (US) 1994-11-23 EP 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