SCHEMBL9537158

SCHEMBL9537158

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

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
PLA2G7 Q13093 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 4/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 1/20 0.45
MRGPRX1 Q96LB2 1/20 0.45
PKM P14618 1/20 0.44

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
SCHEMBL9538105 0.87 HDAC1 (0.51) NPC1RAB9ASMN1; SMN2PLA2G7GAA
SCHEMBL9538389 0.85 BDKRB1 (0.49) SMN1; SMN2PLA2G7MAPTLMNAKMT2A
SCHEMBL9535652 0.81 PTGS2 (0.54) NPC1RAB9ASMN1; SMN2PLA2G7GAA
SCHEMBL5674438 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1
SCHEMBL9539158 0.77 MAPT (0.43) NPC1RAB9ASMN1; SMN2PLA2G7GAA
SCHEMBL9539468 0.77 CMA1 (0.48) SMN1; SMN2PLA2G7GAAMAPTPOLB
SCHEMBL9535456 0.76 AKR1C3 (0.60) SMN1; SMN2ALDH1A1
SCHEMBL441676 0.76 PTGS2 (0.55) NPC1RAB9ASMN1; SMN2GAAMAPT
SCHEMBL29748830 0.76 PTGS2 (0.55) NPC1RAB9ASMN1; SMN2GAAMAPT
SCHEMBL9536230 0.76 PTGS2 (0.55) SMN1; SMN2PLA2G7MAPTPOLBLMNA

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