SCHEMBL328140

SCHEMBL328140

O=C(O)c1ccc(CN2C(=O)C3(COc4cc(O)c(O)cc43)c3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 17/20 0.50
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SCN7A Q01118 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN8A Q9UQD0 1/20 0.47
SCN10A Q9Y5Y9 1/20 0.47
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL10289195 0.90 SCN9A (0.48) SCN9AALDH1A1MEN1KMT2ASCN7A
SCHEMBL2304370 0.89 SCN9A (0.57) SCN9AALDH1A1MEN1KMT2ASCN7A
SCHEMBL281454 0.89 SCN9A (0.61) SCN9AALDH1A1MEN1KMT2ASCN7A
SCHEMBL10289086 0.89 SCN9A (0.53) SCN9AALDH1A1SCN7ASCN5ASCN2A
SCHEMBL328263 0.88 SCN9A (0.56) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL3328410 0.86 SCN9A (0.48) SCN9AALDH1A1MEN1KMT2ASCN7A
SCHEMBL328305 0.84 SCN9A (0.50) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL10289192 0.83 SCN9A (0.52) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL328274 0.83 SCN9A (0.49) SCN9AALDH1A1SCN7ASCN5ASCN2A
SCHEMBL10288983 0.83 SCN9A (0.52) 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-2428515-A1 Spiro-oxindole compounds and their uses as therapeutic agents Xenon Pharmaceuticals Inc. (CA) 2012-03-14 EP disclosed
EP-1888595-B1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2012-02-01 EP disclosed