SCHEMBL2838846

SCHEMBL2838846

O=S(=O)(O)c1ccc(Br)cc1-c1cc(Br)ccc1S(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.48
BCL2 P10415 2/20 0.45
MCL1 Q07820 1/20 0.45
PTPRC P08575 1/20 0.42
CA9 Q16790 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CYP1A2 P05177 1/20 0.40
MAPK1 P28482 1/20 0.40
TGM2 P21980 1/20 0.39
CES1 P23141 1/20 0.39
CA12 O43570 1/20 0.39
LCK P06239 1/20 0.39
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL30626031 0.85 PTGDR2 (0.46) S100A4BCL2MCL1PTPRCCYP1A2
SCHEMBL31357037 0.82 ALOX15 (0.44) S100A4BCL2MCL1CA9CA1
SCHEMBL196908 0.82 S100A4 (0.48) S100A4BCL2MCL1PTPRCCA9
SCHEMBL2172732 0.82 ALOX15 (0.44) S100A4BCL2MCL1CA9CA1
SCHEMBL4446536 0.80 CA12 (0.38) S100A4BCL2MCL1CA9CA1
Hydrochloric Acid SCHEMBL28018014 0.80 ALOX15 (0.43) S100A4BCL2MCL1CA9CA1
SCHEMBL11650766 0.78 HSD11B1 (0.48) S100A4CA9CA1CA2CA7
SCHEMBL6012134 0.78 CA1 (0.49) CA9CA1CA2CA12EDNRB
SCHEMBL6937875 0.78 KDM4E (0.42) S100A4CA9CA1CA2CA4
SCHEMBL10296145 0.78 AKR1B1 (0.49) CA9CA1CA2CA12TDP1

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
US-20120251919-A1 POLYARYLENE-BASED COPOLYMER AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 US disclosed
EP-2489690-A1 POLYARYLENE COPOLYMER AND USES THEREOF Sumitomo Chemical Company Limited (JP) 2012-08-22 EP disclosed
US-20100129729-A1 CEOSSLINKED AROMATIC POLYMER, POLYMER ELECTROLYTE,CATALYST INK, POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTRODE ASSEMBLY AND FUEL CELL SUMITOMO CHEMICAL COMPANY ,LIMITED 2010-05-27 US disclosed
EP-2147943-A1 CROSSLINKED AROMATIC POLYMER, POLYMER ELECTROLYTE, CATALYST INK, POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTRODE ASSEMBLY AND FUEL CELL Sumitomo Chemical Company, Limited (JP) 2010-01-27 EP disclosed
US-20090253015-A1 POLYARYLENE BLOCK COPOLYMER AND USE THEREOF SUMITOMO CHEMICAL COMPANY ,LIMITED (JP) 2009-10-08 US disclosed
EP-1857482-A1 POLYARYLENE BLOCK COPOLYMER AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-11-21 EP disclosed