SCHEMBL8773969

SCHEMBL8773969

O=C(NC1N=C(c2ccccc2F)c2ccccc2N(CC(=O)N2CC3CCC(CC3)C2)C1=O)c1cccc(O)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 19/20 0.68
CCKAR P32238 7/20 0.57

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
SCHEMBL9054267 1.00 CCKBR (0.68) CCKBRCCKAR
SCHEMBL9056028 0.91 CCKBR (0.68) CCKBRCCKAR
SCHEMBL8774000 0.91 CCKBR (0.68) CCKBRCCKAR
SCHEMBL9058360 0.89 CCKBR (0.64) CCKBRCCKAR
SCHEMBL9058358 0.89 CCKBR (0.64) CCKBRCCKAR
SCHEMBL9058628 0.88 CCKBR (0.84) CCKBRCCKAR
SCHEMBL9058629 0.88 CCKBR (0.84) CCKBRCCKAR
SCHEMBL9054748 0.85 CCKBR (0.84) CCKBRCCKAR
SCHEMBL9057154 0.85 CCKBR (0.84) CCKBRCCKAR
SCHEMBL8774072 0.85 CCKBR (0.84) 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