SCHEMBL9536982

SCHEMBL9536982

CON=C(C)c1ccc(NS(C)(=O)=O)c(Sc2ccc(F)cc2F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.49
PTGS1 P23219 2/20 0.49
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
ALOX12 P18054 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RAB9A P51151 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 2/20 0.37
GAA P10253 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
PLA2G7 Q13093 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 2/20 0.34

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
SCHEMBL9539485 0.88 PTGS2 (0.52) PTGS2PTGS1ALDH1A1MAPTPOLB
SCHEMBL9536230 0.84 PTGS2 (0.55) PTGS2PTGS1ALDH1A1MAPTPOLB
SCHEMBL9538909 0.82 PTGS2 (0.53) PTGS2PTGS1ALDH1A1MAPTPOLB
SCHEMBL9537417 0.82 PTGS2 (0.55) PTGS2PTGS1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL9540036 0.81 PTGS2 (0.48) PTGS2ALDH1A1MAPTPOLBMEN1
SCHEMBL9536928 0.81 PTGS2 (0.54) PTGS2PTGS1POLBPLA2G7LMNA
SCHEMBL9536499 0.81 PTGS2 (0.49) PTGS2PTGS1ALDH1A1MAPTPOLB
SCHEMBL9537146 0.80 PTGS2 (0.53) PTGS2PTGS1ALDH1A1POLBRAB9A
SCHEMBL9655123 0.80 PTGS2 (0.50) PTGS2ALDH1A1MAPTPOLBMEN1
SCHEMBL9539328 0.80 PTGS2 (0.50) PTGS2PTGS1ALDH1A1POLBMEN1

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