SCHEMBL15535926

SCHEMBL15535926

CC(C)(C)OC(=O)c1cc(C2CC2)c(OCC2CCC(CF)(CF)CC2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.53
▸ SCN5A Q14524 4/20 0.53

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
SCHEMBL16448617 0.90 SCN9A (0.59) SCN9ASCN5A
SCHEMBL16448627 0.90 SCN9A (0.66) SCN9ASCN5A
SCHEMBL15536475 0.88 SCN9A (0.53) SCN9A
SCHEMBL15558549 0.87 SCN9A (0.64) SCN9ASCN5A
SCHEMBL15557588 0.86 SCN9A (0.65) SCN9ASCN5A
SCHEMBL15557587 0.86 SCN9A (0.65) SCN9ASCN5A
SCHEMBL15550154 0.86 SCN9A (0.52) SCN9ASCN5A
SCHEMBL16448693 0.85 SCN9A (0.52) SCN9ASCN5A
SCHEMBL17061952 0.85 SCN9A (0.52) SCN9ASCN5A
SCHEMBL15536889 0.85 SCN9A (0.56) SCN9ASCN5A

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
EP-2855428-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN Genentech, Inc. (US) 2015-04-08 — — EP disclosed
WO-2013177224-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN GENENTECH, INC. (US) 2013-11-28 — — WO disclosed
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