SCHEMBL2363712

SCHEMBL2363712

N=C(N)C(O)N1C(=O)C2(COc3cc4c(cc32)OCCO4)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.47
SCN7A Q01118 1/20 0.42
SCN5A Q14524 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42

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
SCHEMBL3328828 0.82 SCN9A (0.41) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL15313059 0.81 SCN9A (0.49) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2305156 0.81 SCN9A (0.49) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2306464 0.78 SCN9A (0.52) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL17160825 0.78 SCN9A (0.60) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL3332268 0.77 SCN9A (0.48) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2307122 0.76 SCN9A (0.55) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL15314973 0.76 SCN9A (0.59) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2355930 0.76 SCN9A (0.59) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2306343 0.75 SCN9A (0.56) SCN9ASCN7ASCN5ASCN2ASCN8A

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-2350090-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2011-08-03 EP disclosed
WO-2010045251-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2010-04-22 WO disclosed