SCHEMBL7574096

SCHEMBL7574096

O=S(=O)(Nc1ccccc1O)c1ccc(F)cc1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
GAA P10253 3/20 0.71
MAPT P10636 1/20 0.71
MAPK1 P28482 1/20 0.71
HTT P42858 1/20 0.71
RECQL P46063 1/20 0.71
TSHR P16473 1/20 0.66
UQCRB P14927 1/20 0.65
HSD17B2 P37059 1/20 0.65
KEAP1 Q14145 1/20 0.65
NFE2L2 Q16236 1/20 0.65
CHEK1 O14757 1/20 0.60
CDK8 P49336 1/20 0.60
NEK2 P51955 1/20 0.60
LIMK1 P53667 1/20 0.60
DDX3X O00571 1/20 0.55
GFER P55789 1/20 0.55

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
SCHEMBL7589375 0.87 MEN1 (0.77) MEN1KMT2AGAATSHRKEAP1
SCHEMBL6296987 0.86 GAA (0.93) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL7085112 0.86 GAA (0.75) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL752345 0.85 GAA (0.80) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL3259826 0.83 GAA (1.00) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL6832818 0.83 KMT2A (0.71) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL1348234 0.83 LMNA (0.75) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL3260803 0.83 GAA (0.71) MEN1KMT2AGAAMAPTMAPK1
SCHEMBL7854392 0.82 TSHR (0.70) MEN1KMT2ATSHRKEAP1NFE2L2
SCHEMBL3188254 0.81 GAA (0.69) MEN1KMT2AGAAMAPTMAPK1

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