SCHEMBL7590886

SCHEMBL7590886

O=S(=O)(Nc1cc(Br)c(Br)cc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
MAPK1 P28482 2/20 0.61
GAA P10253 1/20 0.61
MAPT P10636 1/20 0.61
HTT P42858 1/20 0.61
RECQL P46063 1/20 0.61
ACLY P53396 3/20 0.55
UQCRB P14927 3/20 0.53
PGAM1 P18669 1/20 0.51
HSD17B2 P37059 1/20 0.51
CA12 O43570 1/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 1/20 0.50
CA9 Q16790 1/20 0.50
MCOLN3 Q8TDD5 1/20 0.50
TSHR P16473 1/20 0.50
PTGES2 Q9H7Z7 1/20 0.50
EDNRB P24530 1/20 0.50
EDNRA P25101 1/20 0.50

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
SCHEMBL7594976 0.86 UQCRB (0.51) MEN1KMT2AMAPK1GAAMAPT
SCHEMBL7589388 0.82 CCR2 (0.54) MEN1KMT2AGAAHSD17B2CA12
SCHEMBL7595505 0.79 KEAP1 (0.59) MEN1KMT2ACA2TSHR
SCHEMBL5956125 0.79 ALDH1A1 (0.59) GAAMAPTHTTCA12CA2
SCHEMBL7587644 0.79 CES1 (0.58)
SCHEMBL7594857 0.78 CA1 (0.54) MEN1KMT2AGAAHTTCA12
SCHEMBL31681420 0.76 ALDH1A1 (0.71) MEN1KMT2AMAPK1GAAMAPT
SCHEMBL3259826 0.76 GAA (1.00) MEN1KMT2AMAPK1GAAMAPT
SCHEMBL812677 0.76 KMT2A (0.77) MEN1KMT2AMAPK1GAAMAPT
SCHEMBL7594450 0.75 CA2 (0.58) CA12CA2LMNACA9EDNRB

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