SCHEMBL9535611

SCHEMBL9535611

CS(=O)(=O)Nc1ccc(C#N)cc1Sc1cccs1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.56
PARP14 Q460N5 1/20 0.39
NR3C1 P04150 1/20 0.39
SLC22A12 Q96S37 2/20 0.38
GLO1 Q04760 1/20 0.36
PTGS1 P23219 3/20 0.34
PDE7A Q13946 2/20 0.34
KMT2A Q03164 2/20 0.33
TNIK Q9UKE5 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ADRB3 P13945 1/20 0.33
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32

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
SCHEMBL9537263 0.81 SLC22A12 (0.37) PTGS2PARP14NR3C1SLC22A12PTGS1
SCHEMBL9535213 0.78 PTGS2 (0.56) PTGS2GLO1PTGS1KMT2AMEN1
SCHEMBL10622738 0.76 PTGS2 (0.41) PTGS2PARP14NR3C1SLC22A12PTGS1
SCHEMBL9539495 0.74 PDE7A (0.39) PTGS2PDE7AKMT2AMEN1GAA
SCHEMBL9535031 0.74 PTGS2 (0.55) PTGS2PARP14SLC22A12PTGS1
SCHEMBL9536540 0.72 PDE7A (0.55) PDE7AKMT2AMEN1MAPT
SCHEMBL9830505 0.72 PDE7A (0.39) PTGS2PTGS1PDE7AKMT2AMEN1
SCHEMBL6250229 0.71 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL4593012 0.70 TNIK (0.48) PARP14NR3C1SLC22A12TNIKMAPT
SCHEMBL2005491 0.69 SLC22A12 (0.47) PARP14NR3C1SLC22A12

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