SCHEMBL8535202

SCHEMBL8535202

CC(C)(C)OC(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 13/20 0.67
CCKAR P32238 9/20 0.65

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
SCHEMBL8535205 1.00 CCKBR (0.67) CCKBRCCKAR
SCHEMBL5656206 0.87 CCKBR (0.74) CCKBRCCKAR
SCHEMBL644153 0.87 CCKBR (0.74) CCKBRCCKAR
SCHEMBL8774740 0.87 CCKBR (0.74) CCKBRCCKAR
SCHEMBL7547713 0.86 CCKBR (0.50) CCKBRCCKAR
SCHEMBL7547722 0.86 CCKBR (0.50) CCKBRCCKAR
SCHEMBL7544423 0.86 CCKBR (0.51) CCKBRCCKAR
SCHEMBL7544428 0.86 CCKBR (0.51) CCKBRCCKAR
SCHEMBL7544717 0.85 CCKBR (0.55) CCKBRCCKAR
SCHEMBL7544708 0.85 CCKBR (0.55) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763437-A Benzodiazepine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed
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