SCHEMBL2991834

SCHEMBL2991834

CCOP(=O)(CCC(C)=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.58
TSHR P16473 2/20 0.48
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
LMNA P02545 2/20 0.33
SLC15A2 Q16348 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HTT P42858 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
SCHEMBL2990604 0.87 PPARD (0.54) PPARDTSHRALDH1A1MAPTCA12
SCHEMBL29169497 0.85 PPARD (0.52) PPARDTSHRCA12CA1CA2
SCHEMBL2990566 0.83 PPARD (0.39) PPARDALDH1A1
SCHEMBL1276434 0.82 PPARD (0.58) PPARDTSHRALDH1A1TDP1TP53
SCHEMBL2456739 0.80 PPARD (0.56) PPARDTSHRTDP1TP53MAPT
SCHEMBL7922676 0.80 PPARD (0.56) PPARDTSHRALDH1A1TDP1TP53
SCHEMBL28231972 0.80 PPARD (0.40) PPARDTSHRALDH1A1TDP1TP53
SCHEMBL28021210 0.80 PPARD (0.56) PPARDTSHRALDH1A1TDP1TP53
SCHEMBL7425644 0.80 PPARD (0.56) PPARDTSHRALDH1A1TDP1TP53
SCHEMBL5839773 0.80 PPARD (0.56) PPARDTSHRTDP1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed
US-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
CN-102780038-A Nonaqueous electrolyte battery MITSUBISHI CHEM CORP 2012-11-14 CN disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-7705064-B2 Photosensitive compounds, photopolymerizable compositions including the same, and methods of making and using the same HENKEL CORPORATION (US) 2010-04-27 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed
CN-101622751-A Nonaqueous electrolyte solution and nonaqueous electrolyte battery MITSUBISHI CHEM CORP 2010-01-06 CN disclosed
WO-2009014689-A2 PHOTOSENSITIVE COMPOUNDS, PHOTOPOLYMERIZABLE COMPOSITIONS INCLUDING THE SAME, AND METHODS OF MAKING AND USING THE SAME HENKEL CORPORATION (US) 2009-01-29 WO disclosed
US-6534489-B1 Organophosphorus compounds and the use thereof JOMAA PHARMAKA GMBH (DE) 2003-03-18 US disclosed
EP-1133500-B1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF JOMAA PHARMAKA GMBH (DE) 2002-09-11 EP disclosed
EP-1133500-A1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF Jomaa Pharmaka GmbH (DE) 2001-09-19 EP disclosed
WO-2000031085-A1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF JOMAA PHARMAKA GMBH (DE) 2000-06-02 WO disclosed
US-5248655-A 1,2,4-TRIAZOLE-3-YL-ALKANE- OR CYCLOALKANE-PHOSPHONIC ACIDS AS ACTIVE SUBSTANCES IN WEED KILLERS JAPAT LTD. (CH) 1993-09-28 US disclosed
EP-0528760-A1 Novel triazoles Japat Ltd (CH) 1993-02-24 EP disclosed
EP-0453841-A2 Process for the preparation of esters of 1-alcoxyhexatriene-2-carboxylic acid BAYER AG (DE) 1991-10-30 EP disclosed
US-4145510-A AS STARTING MATERIAL IN A FLAMEPROOF POLYURETHANE CIBA-GEIGY CORPORATION (US) 1979-03-20 US disclosed
US-4138569-A FIRE RETARDANT EPOXY RESINS, POLYESTERS AND POLYURETHANES CIBA-GEIGY CORPORATION (US) 1979-02-06 US disclosed
US-4093809-A INTERMEDIATES IN PREPARING FLAME-RETARDANT POLYESTERS AND POLYURETANES CIBA-GEIGY CORPORATION (US) 1978-06-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 PPARD 2150/4885TSHR 3426/4885ALDH1A1 1059/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.