SCHEMBL484130

SCHEMBL484130

O=C(O)CCCNC(=O)NCCN1C(=O)C2(COc3cc4c(cc32)OCO4)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.62
SCN7A Q01118 1/20 0.51
SCN5A Q14524 1/20 0.51
SCN2A Q99250 1/20 0.51
SCN8A Q9UQD0 1/20 0.51
SCN10A Q9Y5Y9 1/20 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
SCHEMBL484142 0.95 SCN9A (0.62) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL484123 0.91 SCN9A (0.62) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281513 0.90 SCN9A (0.75) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281298 0.90 SCN9A (0.63) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281213 0.90 SCN9A (0.76) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281658 0.89 SCN9A (0.75) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281779 0.89 SCN9A (0.61) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281908 0.88 SCN9A (0.62) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281515 0.88 SCN9A (0.71) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281627 0.88 SCN9A (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888595-B1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2012-02-01 EP claimed
EP-2073806-A2 USE OF SPIRO-OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2009-07-01 EP disclosed
WO-2008060789-A2 USE OF SPIRO-OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-05-22 WO disclosed