SCHEMBL16510302

SCHEMBL16510302

Cc1cccc(COc2ncc(F)cc2C(=O)NC2N=C(c3c(Cl)cc(Cl)cc3Cl)c3ccccc3NC2=O)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 16/20 0.51
▸ CCKAR P32238 10/20 0.49

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
SCHEMBL16498261 0.94 CCKBR (0.48) CCKBRCCKAR
SCHEMBL16498409 0.94 CCKBR (0.47) CCKBRCCKAR
SCHEMBL16499181 0.89 CCKBR (0.54) CCKBRCCKAR
SCHEMBL16498218 0.89 CCKBR (0.52) CCKBRCCKAR
SCHEMBL16498744 0.88 CCKBR (0.51) CCKBRCCKAR
SCHEMBL16498325 0.88 CCKBR (0.56) CCKBRCCKAR
SCHEMBL16498467 0.87 CCKBR (0.53) CCKBRCCKAR
SCHEMBL16499200 0.87 CCKBR (0.53) CCKBRCCKAR
SCHEMBL16498187 0.87 CCKBR (0.53) CCKBRCCKAR
SCHEMBL16499180 0.87 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011151651-A1 BENZODIAZEPINE COMPOUNDS USEFUL FOR THE TREATMENT OF HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2011-12-08 — — WO disclosed
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