SCHEMBL8774740

SCHEMBL8774740

CC(C)(C)OC(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2NC1=O

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 16/20 0.74
CCKAR P32238 11/20 0.74

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
SCHEMBL5656206 1.00 CCKBR (0.74) CCKBRCCKAR
SCHEMBL644153 1.00 CCKBR (0.74) CCKBRCCKAR
SCHEMBL644305 0.89 CCKBR (0.69) CCKBRCCKAR
SCHEMBL11981874 0.88 CCKBR (0.62) CCKBRCCKAR
SCHEMBL8672699 0.88 CCKBR (0.62) CCKBRCCKAR
SCHEMBL8535202 0.87 CCKBR (0.67) CCKBRCCKAR
SCHEMBL8535205 0.87 CCKBR (0.67) CCKBRCCKAR
SCHEMBL642206 0.86 CCKBR (0.76) CCKBRCCKAR
SCHEMBL9526556 0.86 CCKAR (1.00) CCKBRCCKAR
SCHEMBL8746538 0.86 CCKAR (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-0804425-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-05 EP disclosed
WO-1996004254-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed