SCHEMBL8545928

SCHEMBL8545928

CN1C(=O)C(NC(=O)Nc2cccc(C#N)c2)C(=O)N(c2ccccc2)c2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 19/20 0.74
CCKAR P32238 3/20 0.54

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
SCHEMBL8640910 0.85 CCKBR (1.00) CCKBRCCKAR
SCHEMBL8540475 0.78 CCKBR (0.51) CCKBRCCKAR
SCHEMBL8542227 0.76 CCKBR (1.00) CCKBRCCKAR
SCHEMBL14180421 0.71 CCKBR (0.82) CCKBR
SCHEMBL8636911 0.71 CCKBR (1.00) CCKBRCCKAR
SCHEMBL21568338 0.71 CCKBR (0.51) CCKBR
SCHEMBL8635376 0.70 CCKBR (1.00) CCKBRCCKAR
SCHEMBL8634876 0.70 CCKBR (1.00) CCKBRCCKAR
SCHEMBL14180459 0.70 CCKBR (0.78) CCKBR
SCHEMBL8641287 0.70 CCKBR (1.00) CCKBRCCKAR

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-0698014-B1 3-PHENYLUREIDO-1,5-BENZODIAZEPINE-DIONES USEFUL AS GASTRIN OR CCK ANTAGONISTS GLAXO WELLCOME SPA (IT) 1998-07-22 EP disclosed
US-5641775-A 3-phenylureido-1,5-benzodiazepine-diones useful as gastrin or antagonists GLAXO SPA (IT) 1997-06-24 US disclosed