SCHEMBL16162152

SCHEMBL16162152

CN(C)S(=O)(=O)Nc1ccc(F)c(NC(=O)Oc2cnc3[nH]cnc3c2)c1F

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRAF P15056 17/20 0.47
PIK3C3 Q8NEB9 2/20 0.34
CYP2C9 P11712 1/20 0.33

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
SCHEMBL16161910 0.86 BRAF (0.51) BRAFCYP2C9
SCHEMBL16162082 0.85 BRAF (0.62) BRAF
SCHEMBL16162151 0.85 CYP2D6 (0.43) BRAFCYP2C9
SCHEMBL287849 0.84 BRAF (0.51) BRAF
SCHEMBL16161898 0.84 CYP2C9 (0.46) BRAFCYP2C9
SCHEMBL16162128 0.84 BRAF (0.44) BRAFCYP2C9
SCHEMBL16161915 0.83 BRAF (0.49) BRAFPIK3C3
SCHEMBL16162131 0.83 BRAF (0.44) BRAF
SCHEMBL16162136 0.83 CYP2C19 (0.40) BRAFPIK3C3CYP2C9
SCHEMBL16162085 0.83 CYP2C19 (0.44) BRAFPIK3C3CYP2C9

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-2170830-B1 2-FLUORO-BENZENESULFONAMIDE COMPOUNDS AS Raf KINASE MODULATORS PLEXXIKON INC (US) 2014-10-15 EP claimed