SCHEMBL7380228

SCHEMBL7380228

CC(C)=CCN(c1ccc(OCc2ccccc2)cc1)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)N2CCCCCC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 20/20 1.00

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
SCHEMBL7039553 0.91 CACNA1B (1.00) CACNA1B
SCHEMBL7039549 0.91 CACNA1B (1.00) CACNA1B
SCHEMBL7041272 0.90 CACNA1B (1.00) CACNA1B
SCHEMBL7041266 0.90 CACNA1B (1.00) CACNA1B
SCHEMBL7043327 0.89 CACNA1B (0.80) CACNA1B
SCHEMBL7043321 0.89 CACNA1B (0.80) CACNA1B
SCHEMBL7040854 0.89 CACNA1B (0.80) CACNA1B
SCHEMBL7040848 0.89 CACNA1B (0.80) CACNA1B
SCHEMBL7042841 0.89 CACNA1B (0.80) CACNA1B
SCHEMBL7350333 0.88 CACNA1B (1.00) 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