SCHEMBL7589397

SCHEMBL7589397

N#Cc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.52
SLC40A1 Q9NP59 1/20 0.47
CCR9 P51686 5/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.46
STAT3 P40763 1/20 0.46
GPR119 Q8TDV5 1/20 0.45
MAPT P10636 1/20 0.44
SLC22A12 Q96S37 2/20 0.43
ACLY P53396 1/20 0.43
CCR2 P41597 1/20 0.43
FBP1 P09467 1/20 0.42

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
SCHEMBL7571564 0.83 AR (0.60) FFAR4PTGDR2MAPTSLC22A12
SCHEMBL7595506 0.81 FFAR4 (0.57) FFAR4CCR9FBP1
SCHEMBL4650259 0.81 GPR119 (0.61) FFAR4GPR119MAPTSLC22A12
SCHEMBL7591774 0.80 TRPA1 (0.46) FFAR4SLC40A1CCR9PTGDR2STAT3
SCHEMBL7577285 0.80 FFAR4 (0.59) FFAR4CCR9MAPT
SCHEMBL7590053 0.78 FFAR4 (0.59) FFAR4SLC40A1CCR9MAPTFBP1
SCHEMBL7569763 0.78 FFAR4 (0.59) FFAR4SLC40A1CCR9MAPTFBP1
SCHEMBL7587888 0.78 KEAP1 (0.54) FFAR4MAPTACLY
SCHEMBL7589336 0.78 SLC22A12 (0.54) SLC40A1STAT3SLC22A12ACLYCCR2
SCHEMBL7573010 0.77 FFAR4 (0.52) FFAR4CCR9STAT3

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-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed