SCHEMBL6535752

SCHEMBL6535752

CCCCCCCCCc1c(S(=O)(=O)O)c(S(=O)(=O)O)c2ccccc2c1CCCCCCCCC.CCCCCCCCCc1c(S(=O)(=O)O)c(S(=O)(=O)O)c2ccccc2c1CCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 3/20 0.45
GAA P10253 1/20 0.43
TLR8 Q9NR97 4/20 0.41
LIPG Q9Y5X9 1/20 0.38
MAPT P10636 2/20 0.38
SLC2A1 P11166 1/20 0.38
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
PTPN1 P18031 1/20 0.37
AGTR1 P30556 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
SCHEMBL11200320 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL1938735 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL36175 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL1938340 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL1036323 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL29707845 1.00 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL27803457 0.98 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10GAA
Ammonia Solution, Strong SCHEMBL9150100 0.98 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10GAA
Ammonia Solution, Strong SCHEMBL9150095 0.98 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7783760 0.97 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309632-A4 ALKYLATED ARYL DISULFONIC ACID CATALYSTS FOR CROSSLINKING POLYETHYLENE KING INDUSTRIES INC (US) 2004-07-28 EP disclosed
EP-1309632-A1 ALKYLATED ARYL DISULFONIC ACID CATALYSTS FOR CROSSLINKING POLYETHYLENE KING INDUSTRIES, INC. (US) 2003-05-14 EP disclosed
WO-2002012355-A1 ALKYLATED ARYL DISULFONIC ACID CATALYSTS FOR CROSSLINKING POLYETHYLENE KING INDUSTRIES, INC. (US) 2002-02-14 WO disclosed
US-4200729-A Curing amino resins with aromatic sulfonic acid oxa-azacyclopentane adducts KING INDUSTRIES, INC (US) 1980-04-29 US disclosed