SCHEMBL17102712

SCHEMBL17102712

CC(C)(C)c1nc(N(C(=O)O)S(=O)(=O)c2cc(Cl)c(Oc3cc(C(F)(F)F)c(F)cc3-c3ccnnc3)cc2F)cs1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.58
CYP2C9 P11712 2/20 0.46
SCN1A P35498 1/20 0.46
SCN2A Q99250 1/20 0.46
SCN8A Q9UQD0 1/20 0.46
SCN5A Q14524 1/20 0.44

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
SCHEMBL320651 0.86 SCN9A (0.60) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL17270581 0.80 SCN9A (0.37) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL17102711 0.80 SCN9A (0.58) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL17270536 0.79 SCN9A (0.41) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL319777 0.78 SCN9A (0.55) SCN9A
SCHEMBL17270551 0.78 SCN9A (0.34) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL17270568 0.77 SCN9A (0.36) SCN9ACYP2C9SCN1ASCN2ASCN8A
SCHEMBL17270556 0.77 SCN9A (0.37) SCN9A
SCHEMBL17270538 0.76 SCN9A (0.47) SCN9ACYP2C9SCN5A
SCHEMBL17270531 0.76 SCN9A (0.37) SCN9ACYP2C9SCN1ASCN2ASCN8A

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
US-9145407-B2 Sulfonamide compounds PFIZER LIMITED (GB) 2015-09-29 US disclosed