SCHEMBL9720211

SCHEMBL9720211

CC(=O)OC(C)C(C)OC(C)=O

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM1 P11229 1/20 0.46
TBXA2R P21731 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
GALR3 O60755 1/20 0.44
MAPT P10636 1/20 0.44
BLM P54132 1/20 0.44
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 3/20 0.37
TRPV1 Q8NER1 1/20 0.37
ALOX15 P16050 1/20 0.36
LMNA P02545 4/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
HRH1 P35367 1/20 0.33
KMT2A Q03164 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
SCHEMBL17751390 1.00 TSHR (0.65) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL10239103 1.00 TSHR (0.65) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL9626093 0.88 TSHR (0.52) TSHRCHRM2CHRM4CHRM1TBXA2R
Ethylene Glycol SCHEMBL1401098 0.88 TSHR (0.52) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL8354344 0.87
SCHEMBL13244792 0.87
SCHEMBL632271 0.87
SCHEMBL23249686 0.84
SCHEMBL29654850 0.84
SCHEMBL24227 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4162363-A BY REACTION WITH OXYGEN AND A CARBOXYLIC ACID COMPONENT PHILLIPS PETROLEUM COMPANY (US) 1979-07-24 US claimed
US-20240016190-A1 ROXBURGH ROSE AND COIX SEEDS COMPOSITE BEVERAGE AND PREPARATION METHOD THEREOF GUIZHOU UNIVERSITY (CN) 2024-01-18 US disclosed
US-11800886-B2 Methods of processing foodstuffs with polyester foam control agents DOW GLOBAL TECHNOLOGIES LLC (US) 2023-10-31 US disclosed
CN-110891615-B System and method for selecting and releasing fragrance 阿甘香气及精细化学有限公司 2022-08-05 CN disclosed
US-20220056385-A1 BUFFERED VINEGAR PRODUCTS WITH REDUCED COLOR, ODOR, AND FLAVOR AND METHODS OF PRODUCING THE SAME Kerry Luxembourg S.a.r.l. (LU) 2022-02-24 US disclosed
EP-3045436-B1 METHOD FOR PRODUCING 1,3-BUTADIENE AND/OR 3-BUTEN-2-OL TORAY INDUSTRIES (JP) 2018-05-02 EP disclosed
CN-105531246-B The manufacture method of 1,3-butadiene and/or 3- butene-2 -ol 东丽株式会社 2017-12-19 CN disclosed
CN-106999972-A System and method for discharging fragrance 阿甘芳香和精细化工有限公司 2017-08-01 CN disclosed
CN-106999973-A System and method for discharging edible material 阿甘芳香和精细化工有限公司 2017-08-01 CN disclosed
US-9452963-B2 Method for producing 1,3-butadiene and/or 3-buten-2-ol TORAY INDUSTRIES, INC. (JP) 2016-09-27 US disclosed
US-20120283160-A1 SYNTHESIS OF BIOLUBRICANT ESTERS FROM UNSATURATED FATTY ACID DERIVATIVES CHEVRON U.S.A. INC. (US) 2012-11-08 US disclosed
US-20120214919-A1 Process DANISCO A/S (DK) 2012-08-23 US disclosed
US-20110009300-A1 SYNTHESIS OF BIOLUBRICANT ESTERS FROM UNSATURATED FATTY ACID DERIVATIVES CHEVRON U.S.A. INC. (US) 2011-01-13 US disclosed
EP-1992614-A1 3-(2-Alkoxy-phenyl)-substituted tetramates Bayer CropScience Aktiengesellschaft (DE) 2008-11-19 EP disclosed
US-5104503-A Radiation in presence of group 2b metal YALE UNIVERSITY (US) 1992-04-14 US disclosed
US-4221916-A Oxidative esterification process PHILLIPS PETROLEUM COMPANY (US) 1980-09-09 US disclosed
US-4221917-A IODOSOARYL DICARBOXYLATE CATALYST PHILLIPS PETROLEUM COMPANY (US) 1980-09-09 US disclosed
US-4220800-A Oxidative esterification process PHILLIPS PETROLEUM COMPANY (US) 1980-09-02 US disclosed
US-4216119-A IN A CARBOXYLIC ACID MEDIA PHILLIPS PETROLEUM COMPANY (US) 1980-08-05 US disclosed
US-4162363-A BY REACTION WITH OXYGEN AND A CARBOXYLIC ACID COMPONENT PHILLIPS PETROLEUM COMPANY (US) 1979-07-24 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-20120214919-A1 Process ACSL4, FADS1, FASN TSHR 1741/4885CHRM2 1396/4885CHRM4 1217/4885

“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.