SCHEMBL3667921

SCHEMBL3667921

[O-][S+](c1cccc(Br)c1)c1cccc(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
MAPK1 P28482 1/20 0.42
C1S P09871 1/20 0.35
PARP1 P09874 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IDO1 P14902 3/20 0.34
AGXT P21549 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
METAP2 P50579 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
HK1 P19367 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
SCHEMBL20048776 0.81 ALDH1A1 (0.39) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL513922 0.81 ALDH1A1 (0.44) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL23943395 0.78 ALDH1A1 (0.41) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL30032212 0.76 CA1 (0.37) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL7380496 0.76 ALDH1A1 (0.35) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL8281840 0.76 ALDH1A1 (0.40) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL24758798 0.76 CA1 (0.37) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL19255037 0.76 ALDH1A1 (0.40) ALDH1A1MAPK1C1SPARP1TAAR1
SCHEMBL20863187 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1TAAR1IDO1AGXT
SCHEMBL28374403 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1TAAR1IDO1AGXT

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 14 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
CN-1220666-C Monomer containing electron drawing group and electron donating group and polymer and proton conductive membrane containing same JSR CORP (JP) 2005-09-28 CN 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
EP-1245554-B1 Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same JSR CORP (JP) 2005-01-26 EP 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-6794480-B2 POLYARYLENE-BASED COPOLYMER USEFUL AS PROTON-CONDUCTIVE MEMBRANE WHICH CAN BE USED AS ELECTRON FOR PRIMARY BATTERY, ELECTROLYTE FOR SECONDARY BATTERY, HIGH MOLECULAR SOLID ELECTROLYTE FOR FUEL CELL JSR CORPORATION (JP) 2004-09-21 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-20020177656-A1 Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same JSR CORPORATION (JP) 2002-11-28 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
CN-1379009-A Monomer containing electron drawing group and electron donating group and polymer and proton conductive membrane containing same JSR CORP (JP) 2002-11-13 CN disclosed
EP-1245554-A1 Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same JSR Corporation (JP) 2002-10-02 EP disclosed
US-4287366-A BY OXIDATION OF THE CORRESPONDING SULFIDE OR SULFOXIDE WITH HYDROGEN PEROXIDE IN THE PRESENCE OF AN ALKALI METAL HYDROXIDE MITSUI TOATSU CHEMICALS, INC. (JP) 1981-09-01 US disclosed
US-4275240-A OXIDATION OF 2,2'-BISPHENOL SULFIDES IN A SOLVENT MITSUI TOATSU CHEMICALS, INC. (JP) 1981-06-23 US disclosed