SCHEMBL4280353

SCHEMBL4280353

O=S(=O)(O)c1ccc2c(O)c(O)c(S(=O)(=O)O)cc2c1.[Na].[Na]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
HIF1A Q16665 3/20 0.54
CYP1A2 P05177 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
MEN1 O00255 1/20 0.54
THRB P10828 1/20 0.54
KMT2A Q03164 1/20 0.54
CASP6 P55212 3/20 0.50
NSD2 O96028 2/20 0.50
DUSP3 P51452 1/20 0.50
PTPN5 P54829 1/20 0.50
PTPN11 Q06124 1/20 0.50
CYP2C9 P11712 3/20 0.49
HSD17B10 Q99714 3/20 0.49
CYP2C19 P33261 2/20 0.49
ENPP2 Q13822 4/20 0.47
PRMT1 Q99873 2/20 0.46
CD40 P25942 1/20 0.46
CD40LG P29965 1/20 0.46
NT5E P21589 1/20 0.46

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
SCHEMBL3203561 1.00 ALDH1A1 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL11759576 0.98 ALDH1A1 (0.53) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL4280346 0.98 ALDH1A1 (0.53) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL13515229 0.87 ALDH1A1 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL9350146 0.86 ALDH1A1 (0.52) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL517711 0.85 CASP6 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL16817741 0.85 CASP6 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL29475260 0.85 CASP6 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL3201539 0.85 CASP6 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1
SCHEMBL28065905 0.84 ALDH1A1 (0.54) ALDH1A1HIF1ACYP1A2TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2084210-A1 SULFONATED POLY(ARYLENE ETHER) CONTAINING CROSSLINKABLE MOITY AT END GROUP, METHOD OF MANUFACTURING THE SAME, AND POLYMER ELECTROLYTE MEMBRANE USING THE SULFONATED POLY(ARYLENE ETHER) AND THE METHOD Gwangju Institute of Science and Technology (KR) 2009-08-05 EP disclosed
WO-2008062932-A1 SULFONATED POLY(ARYLENE ETHER) CONTAINING CROSSLINKABLE MOITY AT END GROUP, METHOD OF MANUFACTURING THE SAME, AND POLYMER ELECTROLYTE MEMBRANE USING THE SULFONATED POLY(ARYLENE ETHER) AND THE METHOD GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-05-29 WO disclosed