SCHEMBL16070149

SCHEMBL16070149

O=S(=O)(Nc1ccncn1)c1c(F)cc(O)cc1F

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 14/20 0.57
SCN5A Q14524 13/20 0.57
SCN8A Q9UQD0 12/20 0.57
SCN9A Q15858 8/20 0.48
SCN2B O60939 3/20 0.48
SCN1B Q07699 3/20 0.48

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
SCHEMBL30201091 0.84 SCN1A (0.54) SCN1ASCN5ASCN8ASCN9ASCN2B
SCHEMBL29482006 0.81 SCN1A (0.50) SCN1ASCN5ASCN8ASCN9ASCN2B
SCHEMBL17454965 0.78 SCN1A (0.50) SCN1ASCN5ASCN8ASCN9ASCN2B
SCHEMBL30201470 0.75 SCN1A (0.49) SCN1ASCN5ASCN8ASCN9ASCN2B
SCHEMBL17454914 0.75 SCN1A (0.58) SCN1ASCN5ASCN8ASCN9ASCN2B
SCHEMBL29835236 0.74 SCN1A (0.59) SCN1ASCN5ASCN8ASCN9A
SCHEMBL29481996 0.74 SCN1A (0.54) SCN1ASCN5ASCN8ASCN9A
SCHEMBL1094422 0.74 SCN1A (0.54) SCN1ASCN5ASCN8ASCN9A
SCHEMBL20237893 0.73 SCN1A (1.00) SCN1ASCN5ASCN8ASCN9ASCN1B
SCHEMBL20259242 0.73 SCN1A (0.78) SCN1ASCN5ASCN8ASCN9ASCN2B

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-2974730-A1 DRUG FOR RESPIRATORY DISEASES DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-01-20 EP disclosed
WO-2014142221-A1 DRUG FOR RESPIRATORY DISEASES 第一三共株式会社 (JP) 2014-09-18 WO disclosed