SCHEMBL742042

SCHEMBL742042

C=CCC(=C)c1ccccc1S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
MYC P01106 1/20 0.34
CA9 Q16790 1/20 0.34
CYP2D6 P10635 2/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
TTR P02766 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 1/20 0.33
FABP4 P15090 1/20 0.33
CCNA2 P20248 1/20 0.33

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
SCHEMBL9678327 0.79 CYP3A4 (0.47) CYP3A4TSHRALDH1A1HSD17B10KDM4E
SCHEMBL6415233 0.79 MYC (0.40) TSHRHSD17B10CA1CA2MYC
SCHEMBL6680322 0.76 CYP3A4 (0.70) CYP3A4TSHRALDH1A1HSD17B10CA1
SCHEMBL29225330 0.74 CYP3A4 (0.68) CYP3A4TSHRALDH1A1HSD17B10CA1
SCHEMBL635616 0.73 CYP2D6 (0.44) ALDH1A1CYP2D6RAB9AHPGD
Sulfuric Acid SCHEMBL4875618 0.73 MAOA (0.41) CYP3A4TSHRALDH1A1KDM4ECYP1A2
SCHEMBL154693 0.72 MYC (0.43) TSHRCA1CA2MYCCA9
SCHEMBL1079613 0.72 CYP3A4 (0.41) CYP3A4TSHRALDH1A1HSD17B10CA1
SCHEMBL11667788 0.72 MYC (0.39) TSHRCA1CA2MYCCA9
SCHEMBL776928 0.72 MYC (0.39) TSHRCA1CA2MYCCA9

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
US-8349513-B2 Polymer electrolyte membrane, membrane-electrode assembly and polymer electrolyte fuel cell KURARAY CO., LTD. (JP) 2013-01-08 US disclosed
EP-1986257-B1 POLYELECTROLYTE FILM, FILM-ELECTRODE ASSEMBLY, AND SOLID-POLYMER-TYPE FUEL CELL KURARAY CO (JP) 2012-05-23 EP disclosed
US-8137860-B2 Polymer electrolyte membrane for solid polymer fuel cell, membrane-electrode assembly and fuel cell KURARAY CO., LTD. (JP) 2012-03-20 US disclosed
US-8012628-B2 Polymer electrochemical device KURARAY CO., LTD. (JP) 2011-09-06 US disclosed
US-20100233569-A1 ELECTROLYTE MULTILAYER MEMBRANE FOR SOLID POLYMER FUEL CELL, MEMBRANE-ELECTRODE ASSEMBLY, AND FUEL CELL KURARAY CO., LTD (JP) 2010-09-16 US disclosed
US-20100167159-A1 POLYELECTROLYTE FILM, FILM-ELECTRODE ASSEMBLY, AND SOLID-POLYMER-TYPE FUEL CELL KURARAY CO., LTD (JP) 2010-07-01 US disclosed
US-7740968-B2 Ion-conductive binder membrane-electrode assembly and fuel cell KURARAY CO., LTD. (JP) 2010-06-22 US disclosed
US-20090123804-A1 Polymer Electrolyte Membrane For Solid Polymer Fuel Cell, Membrane-Electrode Assembly And Fuel Cell KURARAY CO., LTD (JP) 2009-05-14 US disclosed
EP-1986257-A1 POLYELECTROLYTE FILM, FILM-ELECTRODE ASSEMBLY, AND SOLID-POLYMER-TYPE FUEL CELL Kuraray Co., Ltd. (JP) 2008-10-29 EP disclosed
US-20080113244-A1 Ion-Conductive Binder Membrane-Electrode Assembly and Fuel Cell KURARAY CO., LTD (JP) 2008-05-15 US disclosed
US-20080014505-A1 POLYMER ELECTROCHEMICAL DEVICE KURARAY CO., LTD. (JP) 2008-01-17 US disclosed
EP-1870597-A2 Polymer electrochemical device Kuraray Co., Ltd. (JP) 2007-12-26 EP disclosed