SCHEMBL9515958

SCHEMBL9515958

COc1ccc([C@@H]2Cc3cc(OC)ccc3N(CCN(C)C)C(=O)[C@@H]2C)cc1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CACNA1S Q13698 20/20 0.81

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
SCHEMBL9515964 1.00 CACNA1S (0.81) CACNA1S
SCHEMBL9515973 1.00 CACNA1S (0.81) CACNA1S
SCHEMBL9519633 0.92 CACNA1S (0.75) CACNA1S
SCHEMBL9519624 0.92 CACNA1S (0.75) CACNA1S
SCHEMBL9515861 0.92 CACNA1S (0.75) CACNA1S
SCHEMBL10609941 0.89 CACNA1S (1.00) CACNA1S
SCHEMBL10609946 0.89 CACNA1S (1.00) CACNA1S
SCHEMBL9515873 0.89 CACNA1S (0.71) CACNA1S
SCHEMBL9515867 0.89 CACNA1S (0.71) CACNA1S
SCHEMBL9515858 0.89 CACNA1S (0.71) CACNA1S

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0229329-B1 BENZAZEPINE DERIVATIVES E.R. Squibb & Sons, Inc. (US) 1993-07-28 — — EP disclosed
US-4752645-A Benzazepine derivatives E. R. SQUIBB & SONS, INC. (US) 1988-06-21 — — US disclosed
EP-0229329-A1 Benzazepine derivatives E.R. Squibb & Sons, Inc. (US) 1987-07-22 — — EP disclosed
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