SCHEMBL9537263

SCHEMBL9537263

CS(=O)(=O)Nc1ccc(C#N)cc1Sc1ccc(Br)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.37
PTGS2 P35354 3/20 0.36
PARP14 Q460N5 1/20 0.36
NR3C1 P04150 2/20 0.35
TNIK Q9UKE5 1/20 0.32
PGR P06401 3/20 0.31
CXCR2 P25025 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
THRB P10828 1/20 0.31
PTGS1 P23219 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.30
NR3C2 P08235 1/20 0.30
AR P10275 1/20 0.30
ADRB3 P13945 1/20 0.30
FASN P49327 1/20 0.30
CXCR1 P25024 1/20 0.30

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
SCHEMBL9535611 0.81 PTGS2 (0.56) SLC22A12PTGS2PARP14NR3C1TNIK
SCHEMBL9535031 0.72 PTGS2 (0.55) SLC22A12PTGS2PARP14PTGS1
SCHEMBL897113 0.70 PARP14 (0.47) SLC22A12PARP14NR3C1TNIKPGR
SCHEMBL10622738 0.69 PTGS2 (0.41) SLC22A12PTGS2PARP14NR3C1SMN1; SMN2
SCHEMBL4593012 0.69 TNIK (0.48) SLC22A12PARP14NR3C1TNIKPGR
SCHEMBL6389949 0.68 SLC22A12 (0.47) SLC22A12PARP14NR3C1TNIKPGR
SCHEMBL4641810 0.68 SLC22A12 (0.54) SLC22A12PARP14NR3C1TNIKPGR
SCHEMBL2005491 0.68 SLC22A12 (0.47) SLC22A12PARP14NR3C1PGR
SCHEMBL9340013 0.66 PARP14 (0.48) SLC22A12PARP14NR3C1TNIKPGR
SCHEMBL12060800 0.66 SLC22A12 (0.45) SLC22A12PARP14NR3C1TNIKPGR

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