SCHEMBL328294

SCHEMBL328294

CCCCOCCCN1C(=O)C2(COc3cc(O)c(O)cc32)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.65

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
SCHEMBL10289271 0.92 SCN9A (0.72) SCN9A
SCHEMBL6466712 0.89 SCN9A (0.83) SCN9A
SCHEMBL328251 0.88 SCN9A (0.66) SCN9A
SCHEMBL328268 0.85 SCN9A (0.61) SCN9A
SCHEMBL328160 0.84 SCN9A (0.60) SCN9A
SCHEMBL10289199 0.83 SCN9A (0.58) SCN9A
SCHEMBL10289026 0.81 SCN9A (0.60) SCN9A
SCHEMBL10289495 0.80 SCN9A (0.54) SCN9A
SCHEMBL10289188 0.80 SCN9A (0.55) SCN9A
SCHEMBL281851 0.80 SCN9A (0.94) SCN9A

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 1 patent. 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