SCHEMBL16161968

SCHEMBL16161968

CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc(F)c(NC(=O)Oc3cnc4[nH]ccc4c3)c2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.43
MAP3K20 Q9NYL2 1/20 0.41
HSD17B2 P37059 1/20 0.41
CCR9 P51686 2/20 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
SCHEMBL16162153 0.93 BRAF (0.44) BRAFMAP3K20
SCHEMBL16162093 0.89 BRAF (0.45) BRAFMAP3K20
SCHEMBL16162114 0.87 BRAF (0.47) BRAFMAP3K20
SCHEMBL16162081 0.87 CCR9 (0.39) BRAFHSD17B2CCR9
SCHEMBL16162147 0.87 BRAF (0.41) BRAFMAP3K20
SCHEMBL16162154 0.86 MAP3K20 (0.43) BRAFMAP3K20
SCHEMBL298312 0.86 BRAF (0.47) BRAFMAP3K20HSD17B2CCR9
SCHEMBL16162115 0.85 MAP3K20 (0.50) BRAFMAP3K20
SCHEMBL16162126 0.85 BRAF (0.44) BRAFMAP3K20
SCHEMBL16162118 0.85 CYP2C9 (0.46) BRAF

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