SCHEMBL2492479

SCHEMBL2492479

C1COC1.C=CC(=O)OCCO

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.76
ALDH1A1 P00352 4/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
THRB P10828 2/20 0.40

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
Oxirane SCHEMBL6686130 0.94 TSHR (0.79) TSHRALDH1A1TP53HIF1ACYP3A4
Tetrahydrofuran SCHEMBL2311865 0.92 TSHR (0.70) TSHRALDH1A1TP53HIF1ACYP3A4
Cyclopropane SCHEMBL11750295 0.90 TSHR (0.86) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL660331 0.90 TSHR (0.86) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21630258 0.87 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL30363554 0.87 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL14875 0.87
Ethylene SCHEMBL8850416 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene Glycol SCHEMBL8650028 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2457464 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207372-B2 Process for the production of acrylic and methacrylic esters of poly(trimethylene ether) glycol E I DU PONT DE NEMOURS AND COMPANY (US) 2012-06-26 US claimed
US-20100160672-A1 PROCESS FOR THE PRODUCTION OF ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-24 US claimed
US-8362291-B2 poly-1,3-propylene glycol mono or di-(meth)acrylates in combination with a polymerization inhibitor; for coatings and radiation curable applications; desired physical properties and reduced degradation during production; 1,3-propanediol can be a renewable monomer E I DU PONT DE NEMOURS AND COMPANY (US) 2013-01-29 US disclosed
EP-2370500-B1 ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL DU PONT (US) 2012-09-05 EP disclosed
US-8207372-B2 Process for the production of acrylic and methacrylic esters of poly(trimethylene ether) glycol E I DU PONT DE NEMOURS AND COMPANY (US) 2012-06-26 US disclosed
US-8198360-B2 (Meth)acrylic esters of poly(trimethylene ether) glycol and uses thereof E I DU PONT DE NEMOURS AND COMPANY (US) 2012-06-12 US disclosed
EP-2370499-A1 PROCESS FOR THE PRODUCTION OF ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. du Pont de Nemours and Company (US) 2011-10-05 EP disclosed
EP-2370483-A1 (METH)ACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL AND USES THEREOF E. I. du Pont de Nemours and Company (US) 2011-10-05 EP disclosed
EP-2370500-A1 ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. du Pont de Nemours and Company (US) 2011-10-05 EP disclosed
WO-2010074805-A1 PROCESS FOR THE PRODUCTION OF ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-01 WO disclosed
WO-2010074806-A1 (METH)ACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL AND USES THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-01 WO disclosed
WO-2010074803-A1 ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-01 WO disclosed
US-20100160538-A1 ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-24 US disclosed
US-20100160672-A1 PROCESS FOR THE PRODUCTION OF ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-24 US disclosed
US-20100159767-A1 (METH)ACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL AND USES THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-06-24 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-20100160672-A1 PROCESS FOR THE PRODUCTION OF ACRYLIC AND METHACRYLIC ESTERS OF POLY(TRIMETHYLENE ETHER) GLYCOL MMAB, PARG, PAM TSHR 2933/4885ALDH1A1 815/4885TP53 3501/4885

“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.