SCHEMBL9536854

SCHEMBL9536854

CS(=O)(=O)c1ccc([N+](=O)[O-])c(Sc2ccc(F)cc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.52
PTGS1 P23219 3/20 0.52
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
USP7 Q93009 2/20 0.49
USP10 Q14694 1/20 0.49
USP47 Q96K76 1/20 0.49
PDE7A Q13946 2/20 0.42
ALDH3A1 P30838 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
HSPB1 P04792 1/20 0.40
VCAM1 P19320 1/20 0.40
PDE7B Q9NP56 1/20 0.39

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
SCHEMBL9535630 0.80 USP7 (0.53) ATMTDP1USP7USP10USP47
SCHEMBL9538632 0.80 G6PD (0.58) PTGS2PTGS1PTGDR2
SCHEMBL9538420 0.78 USP7 (0.60) ATMTDP1USP7USP10USP47
SCHEMBL1340757 0.77 PDE7A (0.55) ATMTDP1USP7USP10USP47
SCHEMBL28503304 0.77 MAPT (0.56) TDP1PDE7AALDH3A1KMT2AMEN1
SCHEMBL28387623 0.77 HTT (0.60) PDE7AALDH3A1KMT2AMEN1LMNA
SCHEMBL9537312 0.76 USP7 (0.52) ATMTDP1USP7USP10USP47
SCHEMBL9538302 0.76 ATM (0.50) PTGS2ATMTDP1USP7USP10
SCHEMBL9537442 0.76 PTGS2 (0.58) PTGS2PTGS1LMNAPTGDR2
SCHEMBL9535526 0.75 USP7 (0.51) ATMTDP1USP7USP10USP47

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-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