SCHEMBL2289378

SCHEMBL2289378

C=C(C)C(=O)OCC(OCC)OCC

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
THRB P10828 1/20 0.50
ALDH1A1 P00352 6/20 0.39
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
GLO1 Q04760 1/20 0.31
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL1397463 0.91 TSHR (0.53) TSHRTHRBALDH1A1LMNAHSD17B10
Ethylene SCHEMBL1812457 0.89 TSHR (0.52) TSHRTHRBALDH1A1LMNAHSD17B10
Ethylene Glycol SCHEMBL3140323 0.86 TSHR (0.49) TSHRTHRBALDH1A1
SCHEMBL1808894 0.84 THRB (0.49) TSHRTHRBALDH1A1HTT
SCHEMBL29890266 0.84 THRB (0.49) TSHRTHRBALDH1A1
SCHEMBL26607860 0.84 TSHR (0.55) TSHRTHRBALDH1A1
SCHEMBL2535560 0.82 TSHR (0.68) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL7557762 0.82 TSHR (0.57) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL22092356 0.81 ALDH1A1 (0.38) TSHRTHRBALDH1A1
SCHEMBL7175096 0.81 THRB (0.56) TSHRTHRBALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593180-B2 Cross-linkable monomers and polymers and the use thereof CELANESE EMULSIONS GMBH (DE) 2017-03-14 US disclosed
US-20140243468-A1 Cross-Linkable Monomers and Polymers and the Use Thereof CELANESE EMULSIONS GMBH (DE) 2014-08-28 US disclosed
US-8716519-B2 Cross-linkable monomers and polymers and the use thereof CELANESE EMULSIONS GMBH (DE) 2014-05-06 US disclosed
US-8586020-B2 Poly(organophosphazene) composition for biomaterials KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-11-19 US disclosed
US-20130004455-A1 POLY(ORGANOPHOSPHAZENE) COMPOSITION FOR BIOMATERIALS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-01-03 US disclosed
EP-2540764-A2 Poly(organophosphazene) composition for biomaterials Korea Institute of Science and Technology (KR) 2013-01-02 EP disclosed
US-8313771-B2 Phosphazene hydrogels with chemical corss-link, preparation method thereof and use thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-11-20 US disclosed
US-20110190462-A1 Cross-Linkable Monomers and Polymers and the Use Thereof CELANESE EMULSIONS GMBH (DE) 2011-08-04 US disclosed
CN-1198603-C Spray liquid for forming bandages and drug delivery systems 3M INNOVATIVE PROPERTIES CO (US) 2005-04-27 CN disclosed
CN-1331585-A Spray on bandage and drug delivery system 3M INNOVATIVE PROPERTIES CO (US) 2002-01-16 CN disclosed
US-5558516-A PHOTOPOLYMERIZATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-09-24 US disclosed
EP-0706785-A1 Pretreated plastic dental appliances and methods MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-04-17 EP disclosed
US-4605718-A WATER-SOLUBLE ACRYLATES AND ACRYLAMIDE POLYMERS HYDROLYZED TO REACT WITH CELLULOSE FIBERS; PAPERMAKING; HIGH STRENGTH NALCO CHEMICAL COMPANY (US) 1986-08-12 US disclosed
US-4508594-A IMPROVE STRENGTH BY REACTING WATER SOLUBLE POLYMER AND CELLULOSE SUBSTRATE NALCO CHEMICAL COMPANY (US) 1985-04-02 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-20130004455-A1 POLY(ORGANOPHOSPHAZENE) COMPOSITION FOR BIOMATERIALS PHOSPHO1, PGLS, PHYKPL TSHR 4580/4885THRB 4431/4885ALDH1A1 2323/4885

“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.