SCHEMBL7349945

SCHEMBL7349945

CC(C)CCN(c1ccc(CCC(C)(C)C)cc1)C1CCN(CC(C)CC(N)C=O)C1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 13/20 0.40

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
SCHEMBL7349373 0.96 CACNA1B (0.39) CACNA1B
SCHEMBL7349884 0.96 CACNA1B (0.42) CACNA1B
SCHEMBL7353642 0.89 CHIT1 (0.37) CACNA1B
SCHEMBL7355858 0.87 CACNA1B (0.42) CACNA1B
SCHEMBL7350644 0.87 CACNA1B (0.40) CACNA1B
SCHEMBL7354629 0.87 CACNA1B (0.37) CACNA1B
SCHEMBL7350031 0.86 CACNA1B (0.38) CACNA1B
SCHEMBL7037539 0.85 CACNA1B (0.42) CACNA1B
SCHEMBL7037541 0.85 CACNA1B (0.42) CACNA1B
SCHEMBL7354253 0.85 CACNA1B (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999007689-A1 ANILINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1999-02-18 WO disclosed