SCHEMBL1743618

SCHEMBL1743618

CC(C)(C)OC(=O)N(c1cscn1)S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2-c2ccnc(C3CNCCN3C(=O)O)c2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.49
CYP2C9 P11712 2/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL1104994 0.82 SCN9A (0.50) SCN9ACYP2C9CYP3A4
SCHEMBL1104993 0.82 SCN9A (0.66) SCN9ACYP2C9CYP3A4
SCHEMBL9895917 0.81 SCN9A (0.55) SCN9ACYP2C9CYP3A4
SCHEMBL1094935 0.75 SCN9A (0.53) SCN9ACYP2C9CYP3A4
SCHEMBL16120766 0.75 SCN9A (0.45) SCN9ACYP2C9CYP3A4
SCHEMBL1095261 0.75 SCN9A (0.69) SCN9ACYP2C9CYP3A4
SCHEMBL9924965 0.74 SCN9A (0.55) SCN9ACYP2C9
SCHEMBL3475862 0.74 SCN9A (0.45) SCN9ACYP2C9CYP3A4
SCHEMBL319776 0.74 SCN9A (0.56) SCN9A
SCHEMBL18013128 0.73 SCN9A (0.64) SCN9ACYP2C9

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-2385938-A1 SULFONAMIDE DERIVATIVES Pfizer Limited (GB) 2011-11-16 EP disclosed
US-8040476-B2 Display device and method of producing the same MITSUBISHI ELECTRIC CORPORATION (JP) 2011-10-18 US disclosed
WO-2010079443-A1 SULFONAMIDE DERIVATIVES PFIZER LIMITED (GB) 2010-07-15 WO disclosed