SCHEMBL7662276

SCHEMBL7662276

CC1=C(C(=O)O)C(c2cccc(Cl)c2)C(C(=O)NCC=Cc2ccncc2)=C(C)N1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 12/20 0.85

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
SCHEMBL7662274 1.00 CACNA1B (0.85) CACNA1B
SCHEMBL7659984 0.92 CACNA1B (1.00) CACNA1B
SCHEMBL7659989 0.92 CACNA1B (1.00) CACNA1B
SCHEMBL7665030 0.85 CACNA1B (0.63) CACNA1B
SCHEMBL7665035 0.85 CACNA1B (0.63) CACNA1B
SCHEMBL7665835 0.84 CACNA1B (0.84) CACNA1B
SCHEMBL7665839 0.84 CACNA1B (0.84) CACNA1B
SCHEMBL5854472 0.83 CACNA1B (1.00) CACNA1B
SCHEMBL5854477 0.83 CACNA1B (1.00) CACNA1B
SCHEMBL7662973 0.82 CACNA1B (0.81) CACNA1B

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
US-6350762-B1 SELECTIVELY INHIBIT THE ACTION OF N-TYPE CALCIUM CHANNEL; AJINOMOTO CO., INC. (JP) 2002-02-26 US disclosed
EP-1043314-A1 NOVEL DIHYDROPYRIDINE DERIVATIVE Ajinomoto Co., Inc. (JP) 2000-10-11 EP disclosed