SCHEMBL8923583

SCHEMBL8923583

NC(=O)N(c1cccc(Cl)c1)C1CCCC(C2CCCCC2)N(CC(=O)OC2C3CC4CC(C3)CC2C4)C1=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CCR1 P32246 1/20 0.31
CCR2 P41597 1/20 0.31
HSD11B1 P28845 1/20 0.30
TP53 P04637 1/20 0.30
MDM2 Q00987 1/20 0.30

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
SCHEMBL8924472 0.91 L3MBTL1 (0.33) L3MBTL1ALDH1A1CCR1CCR2
SCHEMBL8922114 0.90 MDM2 (0.32) HSD11B1TP53MDM2
SCHEMBL8922635 0.90 OPRM1 (0.33) ALDH1A1
SCHEMBL9362140 0.88 L3MBTL1 (0.33) L3MBTL1ALDH1A1CCR1CCR2HSD11B1
SCHEMBL8919291 0.87 CCKBR (0.32) L3MBTL1ALDH1A1CCR1CCR2HSD11B1
SCHEMBL8922628 0.85 PLA2G10 (0.35) L3MBTL1ALDH1A1CCR1CCR2TP53
SCHEMBL9362772 0.84 HSD11B1 (0.36) L3MBTL1ALDH1A1HSD11B1
SCHEMBL8922568 0.81 MAPT (0.32) L3MBTL1ALDH1A1HSD11B1TP53
SCHEMBL9365841 0.78 NPSR1 (0.32) L3MBTL1ALDH1A1CCR1CCR2
SCHEMBL8920231 0.78 CCKBR (0.31) TP53MDM2

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 4 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
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