SCHEMBL9040464

SCHEMBL9040464

Cc1cccc(NC(=O)NC2C=C(c3ccccc3)c3ccccc3N(C)C2=O)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.67
KCNH2 Q12809 1/20 0.67

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
SCHEMBL9038361 0.89 CCKBR (0.67) CCKBRKCNH2
SCHEMBL9039394 0.89 CCKBR (0.66) CCKBRKCNH2
SCHEMBL9037933 0.87 CCKBR (0.68) CCKBRKCNH2
SCHEMBL9038493 0.86 CCKBR (0.69) CCKBRKCNH2
SCHEMBL9039706 0.85 CCKBR (0.56) CCKBRKCNH2
SCHEMBL9038055 0.85 CCKBR (0.71) CCKBRKCNH2
SCHEMBL9873046 0.85 CCKBR (0.60) CCKBRKCNH2
SCHEMBL9039602 0.84 CCKBR (0.57) CCKBR
SCHEMBL4624938 0.84 CYP3A4 (0.71) CCKBRKCNH2
SCHEMBL9039704 0.84 CCKBR (0.60) CCKBR

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
EP-0703222-A1 3-AMINOAZEPINE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-03-27 EP disclosed