SCHEMBL4311014

SCHEMBL4311014

Nc1cccc2cc(S(=O)(=O)Cl)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.51
CYP2C9 P11712 5/20 0.51
CYP2C19 P33261 5/20 0.51
ATIC P31939 1/20 0.51
ALDH1A1 P00352 7/20 0.45
CYP3A4 P08684 5/20 0.45
HPGD P15428 3/20 0.45
TSHR P16473 2/20 0.45
KEAP1 Q14145 1/20 0.45
CASP6 P55212 3/20 0.41
TTR P02766 1/20 0.41
CYP1A2 P05177 3/20 0.40
CYP2D6 P10635 3/20 0.40
LMNA P02545 3/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
TP53 P04637 1/20 0.39
SCN9A Q15858 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 2/20 0.37

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
SCHEMBL1807955 0.84 LMNA (0.58) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL29941351 0.82 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL29518641 0.82 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL3246905 0.82 HSD17B10 (0.51) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL157169 0.82 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL28471752 0.82 HSD17B10 (0.51) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL3246907 0.81 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL28471751 0.81 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICALDH1A1
Water SCHEMBL7704455 0.81 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICALDH1A1
SCHEMBL19414339 0.80 HSD17B10 (0.39) HSD17B10CYP2C9CYP2C19ATICALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100551944-C Polymer solid electrolyte NIPPON SODA CO (JP) 2009-10-21 CN disclosed
US-7579401-B2 Block polymer of polymethoxypolyethylene glycol monomethyl methacrylate and polystyrene; LiClO4 a lithium salt as electrolyte; living copolymerization, block polymerization; excellent thermal characteristics, physical characteristics, and ionic conductivity; secondary batteries NIPPON SODA CO., LTD. (JP) 2009-08-25 US disclosed
EP-1553117-B1 SOLID POLYMER ELECTROLYTE NIPPON SODA CO (JP) 2007-01-17 EP disclosed
US-20050256256-A1 Block polymer of polymethoxypolyethylene glycol monomethyl methacrylate and polystyrene; LiClO4 a lithium salt as electrolyte; living copolymerization, block polymerization; excellent thermal characteristics, physical characteristics, and ionic conductivity; secondary batteries NIPPON SODA CO., LTD (JP) 2005-11-17 US disclosed
CN-1668662-A Solid polymer electrolyte NIPPON SODA CO (JP) 2005-09-14 CN disclosed
EP-1553117-A1 SOLID POLYMER ELECTROLYTE NIPPON SODA CO., LTD. (JP) 2005-07-13 EP disclosed