SCHEMBL7591561

SCHEMBL7591561

Cc1cc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.64
CCR9 P51686 6/20 0.52
FBP1 P09467 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47
TP53 P04637 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
S100A9 P06702 1/20 0.45

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
SCHEMBL7589382 0.86 FFAR4 (0.71) FFAR4CCR9ALDH1A1GAASMN1; SMN2
SCHEMBL7594352 0.82 HSD17B2 (0.52) CCR9ALDH1A1LMNAGAAHTT
SCHEMBL12407078 0.81 FFAR4 (0.55) FFAR4CCR9LMNAGAATP53
SCHEMBL29087421 0.80 KMT2A (0.64) FFAR4CCR9FBP1GAA
SCHEMBL7569763 0.79 FFAR4 (0.59) FFAR4CCR9FBP1GAA
SCHEMBL7590053 0.79 FFAR4 (0.59) FFAR4CCR9FBP1GAATP53
SCHEMBL7577285 0.78 FFAR4 (0.59) FFAR4CCR9ALDH1A1LMNAGAA
SCHEMBL9930848 0.78 CCR2 (0.71)
SCHEMBL7588981 0.77 ALDH1A1 (0.64) FFAR4ALDH1A1LMNAGAAHTT
SCHEMBL7595506 0.77 FFAR4 (0.57) FFAR4CCR9FBP1SMN1; SMN2

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