SCHEMBL7353032

SCHEMBL7353032

CC(C)CCN(c1ccc(OCc2ccccc2)cc1)C1CCN(C(=O)C(C(N)=O)c2ccccn2)CC1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 19/20 0.62
PRMT5 O14744 1/20 0.41

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
SCHEMBL7350936 0.89 CACNA1B (0.62) CACNA1BPRMT5
SCHEMBL7040107 0.85 CACNA1B (0.61) CACNA1BPRMT5
SCHEMBL7351480 0.84 CACNA1B (0.59) CACNA1BPRMT5
SCHEMBL7043419 0.84 CACNA1B (0.69) CACNA1BPRMT5
SCHEMBL7043688 0.83 CACNA1B (0.77) CACNA1B
SCHEMBL7045394 0.83 CACNA1B (0.77) CACNA1B
SCHEMBL7036885 0.83 CACNA1B (0.77) CACNA1B
SCHEMBL7424711 0.82 CACNA1B (0.62) CACNA1B
SCHEMBL7350815 0.82 CACNA1B (0.62) CACNA1B
SCHEMBL7040858 0.82 CACNA1B (0.64) 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
WO-1999007689-A1 ANILINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1999-02-18 WO claimed
WO-1999007689-A1 ANILINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1999-02-18 WO disclosed