SCHEMBL9538398

SCHEMBL9538398

CC(=O)c1ccc(NS(C)(=O)=O)c(Sc2ccc(Cl)cc2Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.55
PTGS2 P35354 2/20 0.55
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
ITGB2 P05107 7/20 0.40
ICAM1 P05362 7/20 0.40
ITGAL P20701 7/20 0.40
USP7 Q93009 3/20 0.40
CCR9 P51686 2/20 0.39
USP47 Q96K76 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
HPGD P15428 1/20 0.38
CCR2 P41597 1/20 0.37

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
SCHEMBL9539520 0.86 ALDH1A1 (0.45) PTGS1PTGS2ALDH1A1SMN1; SMN2MEN1
SCHEMBL9538401 0.85 ALDH1A1 (0.44) PTGS1PTGS2ALDH1A1SMN1; SMN2MAPT
SCHEMBL6598563 0.81 PTGS1 (0.58) PTGS1PTGS2ALDH1A1MEN1MAPT
SCHEMBL9539406 0.80 PTGS1 (0.54) PTGS1PTGS2ALDH1A1MEN1MAPT
SCHEMBL4575696 0.79 PTGS1 (0.56) PTGS1PTGS2ITGB2ICAM1ITGAL
SCHEMBL9537401 0.79 FLT1 (0.44) PTGS1PTGS2FLT1FLT4KDR
SCHEMBL9536230 0.78 PTGS2 (0.55) PTGS1PTGS2ALDH1A1SMN1; SMN2MAPT
SCHEMBL9535010 0.77 PTGS2 (0.54) PTGS1PTGS2ALDH1A1SMN1; SMN2MAPT
SCHEMBL9624571 0.77 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2MEN1KMT2AAKR1C3
SCHEMBL9535361 0.77 ITGB2 (0.50) ALDH1A1MEN1MAPTKMT2AITGB2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0292979-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-21 EP disclosed
US-5034417-A Antiinflammatory agents or analgesics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0292979-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-30 EP disclosed