SCHEMBL15536909

SCHEMBL15536909

O=C(O)c1cc(C2CC2)c(OCC23CC4(F)CC(F)(CC(F)(C4)C2)C3)cc1F

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.70
SCN5A Q14524 10/20 0.70
SCN7A Q01118 3/20 0.51

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
SCHEMBL17422972 0.88 SCN9A (0.57) SCN9ASCN5ASCN7A
SCHEMBL16448662 0.87 SCN9A (0.73) SCN9ASCN5ASCN7A
SCHEMBL19064848 0.87 SCN9A (0.58) SCN9ASCN5ASCN7A
SCHEMBL17423156 0.84 SCN9A (0.60) SCN9ASCN5ASCN7A
SCHEMBL15536874 0.83 SCN9A (0.81) SCN9ASCN5ASCN7A
SCHEMBL15547331 0.83 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL17423017 0.83 SCN9A (0.61) SCN9ASCN5ASCN7A
SCHEMBL17428289 0.83 SCN9A (0.61) SCN9ASCN5ASCN7A
SCHEMBL16448509 0.82 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL15535757 0.81 SCN9A (0.69) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3166939-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF Genentech, Inc. (US) 2017-05-17 EP disclosed
WO-2016007534-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-01-14 WO disclosed
EP-2855428-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN Genentech, Inc. (US) 2015-04-08 EP disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 US disclosed
WO-2013177224-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN GENENTECH, INC. (US) 2013-11-28 WO disclosed