SCHEMBL9534404

SCHEMBL9534404

CNC(=O)c1ccc(NS(C)(=O)=O)c(Nc2ccc(F)cc2F)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.55
MAPK14 Q16539 3/20 0.51
PLA2G7 Q13093 1/20 0.46
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
GAA P10253 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
ACLY P53396 1/20 0.40

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
SCHEMBL9535652 0.87 PTGS2 (0.54) PTGS2PLA2G7GAANPC1RAB9A
SCHEMBL9539469 0.86 PTGS2 (0.53) PTGS2MAPK14PLA2G7CYP1A2CYP3A4
SCHEMBL9657068 0.80 PTGS2 (0.53) PTGS2MAPK14PLA2G7CYP1A2CYP3A4
SCHEMBL9537146 0.80 PTGS2 (0.53) PTGS2MAPK14PLA2G7CYP1A2CYP3A4
SCHEMBL9540036 0.79 PTGS2 (0.48) PTGS2MAPK14PLA2G7CYP1A2CYP3A4
SCHEMBL9536533 0.77 ALDH1A1 (0.47) MAPK14CYP1A2CYP3A4CYP2C19GAA
SCHEMBL9538416 0.76 PTGS2 (0.53) PTGS2PLA2G7
SCHEMBL10626704 0.76 PTGS2 (0.56) PTGS2PLA2G7LMNAACLY
SCHEMBL9534684 0.74 PTGS2 (0.54) PTGS2PLA2G7ALDH1A1LMNA
SCHEMBL9538281 0.74 CA1 (0.44) PTGS2GAANPC1RAB9ASMN1; SMN2

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