SCHEMBL4726281

SCHEMBL4726281

O=C(C=CC(=O)OO)OO

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
EGLN3 Q9H6Z9 1/20 0.31

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
SCHEMBL5550025 1.00 HCAR2 (0.47) HCAR2KEAP1NFE2L2ATMKDM4E
SCHEMBL4726279 1.00 HCAR2 (0.47) HCAR2KEAP1NFE2L2ATMKDM4E
SCHEMBL11672306 0.96 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMKDM4E
SCHEMBL11672297 0.96 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMKDM4E
SCHEMBL11870466 0.96 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMKDM4E
SCHEMBL160450 0.87
Ethylene Glycol SCHEMBL28699494 0.87 HCAR2 (0.38) HCAR2KEAP1NFE2L2ATMTSHR
SCHEMBL476154 0.87
SCHEMBL3888757 0.87
SCHEMBL17536074 0.84 NFE2L2 (0.77) HCAR2KEAP1NFE2L2KDM4EMAPT

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114149546-A Viscosity-reducing polycarboxylate superplasticizer and preparation method thereof 史才军 2022-03-08 CN claimed
US-5644004-A Multi-component ethylenically unsaturated peroxyesters ELF ATOCHEM NORTH AMERICA, INC. (US) 1997-07-01 US claimed
CN-114149546-A Viscosity-reducing polycarboxylate superplasticizer and preparation method thereof 史才军 2022-03-08 CN disclosed
CN-112210466-A Method for producing cherry vinegar by utilizing cherry wine lees 山西大学 2021-01-12 CN disclosed
CN-103260623-B 4-[(S)-(4-chlorophenyl)-2-pyridinylmethoxy compositions 伊斯塔制药公司 2016-11-02 CN disclosed
EP-0879224-B2 NOVEL POLY(MONOPEROXYCARBONATES) ARKEMA INC (US) 2013-12-25 EP disclosed
CN-103260623-A Bepotastine compositions ISTA PHARMACEUTICALS INC 2013-08-21 CN disclosed
US-20120289006-A1 METHOD OF MANUFACTURING POLY-SILICON TFT ARRAY SUBSTRATE BOE TECHNOLOGY GROUP CO., LTD. (CN) 2012-11-15 US disclosed
WO-2008015423-A1 QUINOLINE AND QUINOXALINE N-OXIDES AS CHK-1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2008-02-07 WO disclosed
WO-2008015429-A2 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2008-02-07 WO disclosed
EP-1382596-B1 Novel poly (monoperoxycarbonates) ARKEMA INC (US) 2007-02-14 EP disclosed
EP-0667339-B1 Novel unsaturated peroxides, polymeric peroxides derived therefrom and their uses ATOCHEM NORTH AMERICA ELF (US) 1998-05-06 EP disclosed
WO-1998007684-A1 NOVEL POLY(MONOPEROXYCARBONATES) ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-02-26 WO disclosed
US-5644004-A Multi-component ethylenically unsaturated peroxyesters ELF ATOCHEM NORTH AMERICA, INC. (US) 1997-07-01 US disclosed
US-5494988-A FREE RADICAL INITIATORS AS MONOMERS; CROSSLINKING UNSATURATED POLYESTERS; ADDITION, GRAFT AND BLOCK POLYMERIZATION; COMPATIBILIZING BLENDS ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-02-27 US disclosed
US-5489699-A USED AS FREE RADICAL GENERATOR, POLYMERIZING ETHYNICALLY UNSATURATED MONOMERS, CURING AGENT, RHEOLOGICAL MODIFIER,AND FOR GRAFTING AND COMPATIBILIZING POLYMER BLEND ELFATOCHEM NORTH AMERICA, INC. (US) 1996-02-06 US disclosed
US-5475072-A Curing; crosslinking; modifiying; grafting; compatibilizing ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-12-12 US disclosed
EP-0667339-A1 Novel unsaturated peroxides, polymeric derived therefrom and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-08-16 EP disclosed
US-5420173-A Curing unsaturated polyesters and peroxyester compositions ARKEMA INC. 1995-05-30 US disclosed
US-4009150-A CHELATE COMPOUNDS, REDUCING AGENTS, INITIATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-02-22 US disclosed