SCHEMBL7589336

SCHEMBL7589336

N#Cc1ccc(NS(=O)(=O)c2ccccc2)c(NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.54
ACLY P53396 4/20 0.53
CCR2 P41597 1/20 0.52
PTGES2 Q9H7Z7 2/20 0.50
PGR P06401 1/20 0.50
CYP19A1 P11511 1/20 0.50
KAT6A Q92794 2/20 0.48
GLO1 Q04760 1/20 0.48
SLC40A1 Q9NP59 1/20 0.48
ERBB2 P04626 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HSP90AB1 P08238 1/20 0.48
STAT3 P40763 1/20 0.47

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
SCHEMBL18299831 0.86 SLC22A12 (0.51) SLC22A12ACLYCCR2PTGES2PGR
SCHEMBL21865747 0.86 RXFP1 (0.55) SLC22A12ACLYPTGES2PGRSTAT3
SCHEMBL7859592 0.86 SLC22A12 (0.51) SLC22A12ACLYCCR2PTGES2PGR
SCHEMBL18299624 0.86 SLC22A12 (0.51) SLC22A12ACLYCCR2PTGES2PGR
SCHEMBL7587888 0.84 KEAP1 (0.54) ACLY
SCHEMBL21866537 0.82 GAA (0.52) SLC22A12ACLYCCR2PTGES2CYP19A1
SCHEMBL27519445 0.82 MAPT (0.60) SLC22A12ACLYCCR2PTGES2PGR
SCHEMBL7496445 0.81 ACLY (0.52) ACLYCCR2PTGES2KAT6A
SCHEMBL7940030 0.81 HDAC1 (0.50) SLC22A12ACLYCCR2PTGES2KAT6A
SCHEMBL7490402 0.81 GPR27 (0.51) SLC22A12CCR2PTGES2ERBB2HSP90AA1

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