SCHEMBL9361986

SCHEMBL9361986

CNc1cccc(N(C(N)=O)C2CC(c3ccccc3)CC(c3ccccc3)N(N(C(C)=O)C(C)(C)C)C2=O)c1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 18/20 0.37
GRIN2B Q13224 2/20 0.30
CCKAR P32238 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
SCHEMBL9365828 0.90 CCKBR (0.37) CCKBR
SCHEMBL9362630 0.89 CCKBR (0.40) CCKBRGRIN2B
SCHEMBL9362676 0.89 CCKBR (0.33) CCKBR
SCHEMBL9363000 0.89 CCKBR (0.33) CCKBR
SCHEMBL8919334 0.89 CCKBR (0.40) CCKBRGRIN2B
SCHEMBL9362251 0.87 CCKBR (0.42) CCKBRGRIN2B
SCHEMBL9363055 0.87 CCKBR (0.33) CCKBR
SCHEMBL9365784 0.86 SIGMAR1 (0.35) CCKBR
SCHEMBL9362255 0.86 GRIN2B (0.37) CCKBRGRIN2B
SCHEMBL9367185 0.85 CCKBR (0.44) CCKBRGRIN2B

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-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