SCHEMBL7570701

SCHEMBL7570701

O=S(=O)(Nc1cccc(O)c1NS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 2/20 0.60
HSD17B2 P37059 2/20 0.59
UQCRB P14927 1/20 0.59
MEN1 O00255 2/20 0.56
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
KMT2A Q03164 2/20 0.56
LMNA P02545 1/20 0.56
ERAP1 Q9NZ08 1/20 0.56
SLC40A1 Q9NP59 1/20 0.55
PGAM1 P18669 1/20 0.54
HSD11B1 P28845 1/20 0.52
ACLY P53396 1/20 0.49
KDM1A O60341 1/20 0.49
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.49
RECQL P46063 1/20 0.49
KCNA5 P22460 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL7578819 0.86 MEN1 (0.63) PTGES2HSD17B2MEN1KMT2ALMNA
SCHEMBL7574025 0.82 FFAR4 (0.56) PTGES2HSD17B2UQCRBMEN1MAPT
SCHEMBL7579231 0.82 GAA (0.54) HSD17B2UQCRBMEN1MAPTHTT
SCHEMBL7572310 0.82 ALDH1A1 (0.66) HSD17B2UQCRBMEN1MAPTHTT
SCHEMBL7570770 0.82 GAA (0.61) HSD17B2UQCRBMEN1MAPTHTT
SCHEMBL7588697 0.81 PTGES2 (0.74) PTGES2HSD17B2UQCRBMEN1MAPT
SCHEMBL7579848 0.78 GAA (0.50) HSD17B2UQCRBMEN1MAPTHTT
SCHEMBL14403258 0.78 PTGES2 (0.65) PTGES2HSD17B2UQCRBMEN1MAPT
SCHEMBL12406982 0.76 PTGES2 (0.56) PTGES2MEN1MAPTHTTKMT2A
SCHEMBL7572596 0.75 MEN1 (0.67) PTGES2MEN1MAPTHTTKMT2A

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