SCHEMBL3673670

SCHEMBL3673670

O=S(=O)(Oc1ccc(-c2ccc(Oc3ccc(-c4ccc(OS(=O)(=O)C(F)(F)F)cc4)cc3)cc2)cc1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.50
PTPN1 P18031 1/20 0.48
CA2 P00918 5/20 0.47
CA1 P00915 4/20 0.47
CA9 Q16790 4/20 0.47
CXCR2 P25025 2/20 0.43
CXCR1 P25024 1/20 0.42
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
SOS1 Q07889 2/20 0.38
GSTP1 P09211 1/20 0.38
DRD2 P14416 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
DRD5 P21918 1/20 0.38
DRD3 P35462 1/20 0.38
BCL2L1 Q07817 2/20 0.37
MCL1 Q07820 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 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
SCHEMBL1713465 0.94 KIF11 (0.55) KIF11PTPN1CA2CA1CA9
SCHEMBL5179823 0.94 PTPN1 (0.53) KIF11PTPN1CA2CA1CA9
Biphenyl SCHEMBL1416726 0.89 CA1 (0.55) KIF11PTPN1CA2CA1CA9
SCHEMBL24360466 0.88 CA2 (0.62) KIF11PTPN1CA2CA1CA9
SCHEMBL5532552 0.88 CA2 (0.62) KIF11PTPN1CA2CA1CA9
SCHEMBL576035 0.87 CA2 (0.50) KIF11PTPN1CA2CA1CA9
SCHEMBL3669696 0.87 FFAR4 (0.48) KIF11PTPN1CA2CA1CA9
Hydrogen Sulfide SCHEMBL27563348 0.86 CA1 (0.60) PTPN1CA2CA1CA9CXCR2
SCHEMBL24038175 0.86 KIF11 (0.49) KIF11CA2CA1CA9CXCR2
SCHEMBL3670256 0.84 GSTP1 (0.46) PTPN1CA2CA1CA9GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1329444-B1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR CORP (JP) 2010-05-05 EP disclosed
EP-1138712-B1 Polyarylene copolymers and proton-conductive membrane JSR CORP (JP) 2006-01-18 EP disclosed
US-6933068-B2 Polymer electrolyte membrane and solid polymer electrolyte fuel cell using same HONDA GIKEN KOGYO KABUSHIKI KAISHA (JP) 2005-08-23 US disclosed
US-6833426-B2 A proton-conductive membrane containing the sulfonic acid group-containing polyarylene (co)polymer JSR CORPORATION (JP) 2004-12-21 US disclosed
US-6812290-B2 FOR USE AS ELECTROLYTES JSR CORPORATION (JP) 2004-11-02 US disclosed
US-20030195301-A1 Polyarylene copolymers and proton-conductive membrane JSR CORPORATION (JP) 2003-10-16 US disclosed
US-20030173547-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR CORPORATION (JP) 2003-09-18 US disclosed
EP-1329444-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR Corporation (JP) 2003-07-23 EP disclosed
US-6555626-B2 Controlled amount of sulfonic acid groups; copolymer of an aromatic compound having a main chain containing electron withdrawing groups and aromatic compounds with no electron withdrawing groups; durability, strength, conductivity JSR CORPORATION (JP) 2003-04-29 US disclosed
US-20020172850-A1 Polymer electrolyte membrane and solid polymer electrolyte fuel cell using same HONDA GIKEN KOGYO KABUSHIKI KAISHA, JSR CORPORATION 2002-11-21 US disclosed
US-20010037000-A1 Polyarylene copolymers and proton-conductive membrane JSR CORPORATION (JP) 2001-11-01 US disclosed
EP-1138712-A2 Polyarylene copolymers and proton-conductive membrane JSR Corporation (JP) 2001-10-04 EP disclosed