SCHEMBL7273498

SCHEMBL7273498

CC1=C(C(=O)O)C(c2cccc(Cl)c2)C(P(C(C)C)C(C)C)=C(C)N1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 13/20 0.54

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
SCHEMBL7272993 0.86 CACNA1B (0.54) CACNA1B
SCHEMBL4503644 0.85 CACNA1B (0.65) CACNA1B
SCHEMBL7275261 0.83 CACNA1B (0.54) CACNA1B
SCHEMBL7265750 0.83 CACNA1F (0.53) CACNA1B
SCHEMBL7272933 0.83 CACNA1F (0.53) CACNA1B
SCHEMBL7272505 0.82 PDE1C (0.56) CACNA1B
SCHEMBL7273069 0.80 CACNA1F (0.43) CACNA1B
SCHEMBL7267108 0.80 CACNA1B (0.38) CACNA1B
SCHEMBL7669189 0.80 CACNA1B (0.61) CACNA1B
SCHEMBL7275400 0.80 CACNA1B (0.67) 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-4920225-A Resolution of 1,4-dihydropyridine derivatives LABORATOIRES SYNTEX S.A. (FR) 1990-04-24 US disclosed
EP-0273349-A2 Resolution of 1,4-dihydropyridine derivatives LABORATOIRES SYNTEX S.A. (FR) 1988-07-06 EP disclosed