SCHEMBL9538310

SCHEMBL9538310

CS(=O)(=O)Nc1ccc(C(=O)Cc2ccccc2)cc1Sc1ccc(F)cc1F

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.48
PTGS1 P23219 1/20 0.48
NR3C1 P04150 2/20 0.41
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.37
TP53 P04637 2/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL9536305 0.86 PTGS2 (0.52) PTGS2PTGS1POLBTP53LMNA
SCHEMBL9536630 0.86 MAPT (0.48) PTGS2PTGS1ALDH1A1POLBMAPT
SCHEMBL9537336 0.85 PTGS2 (0.51) PTGS2PTGS1ALDH1A1POLBTP53
SCHEMBL9537417 0.85 PTGS2 (0.55) PTGS2PTGS1ALDH1A1RAB9A
SCHEMBL9536230 0.82 PTGS2 (0.55) PTGS2PTGS1ALDH1A1POLBMAPT
SCHEMBL9868559 0.82 PTGS2 (0.48) PTGS2PTGS1ALDH1A1RAB9AMAPT
SCHEMBL9536986 0.82 PTGS1 (0.48) PTGS2PTGS1HDAC3HDAC1HDAC2
SCHEMBL9536928 0.82 PTGS2 (0.54) PTGS2PTGS1POLBLMNA
SCHEMBL9538909 0.81 PTGS2 (0.53) PTGS2PTGS1ALDH1A1RAB9APOLB
SCHEMBL9537146 0.81 PTGS2 (0.53) PTGS2PTGS1ALDH1A1RAB9APOLB

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