SCHEMBL822924

SCHEMBL822924

O=C(CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC(=O)OCC(O)CO)OCC(O)CO

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.79
DUSP3 P51452 1/20 0.79
MEN1 O00255 1/20 0.79
KMT2A Q03164 1/20 0.79
LMNA P02545 1/20 0.79
DGKA P23743 1/20 0.66
LPAR1 Q92633 6/20 0.54
LPAR4 Q99677 2/20 0.54
LPAR5 Q9H1C0 2/20 0.54
LPAR2 Q9HBW0 2/20 0.54
LPAR3 Q9UBY5 2/20 0.54
ENPP2 Q13822 2/20 0.54
LPAR6 P43657 1/20 0.54
FAAH O00519 2/20 0.54
MAPT P10636 1/20 0.52
PRKCA P17252 3/20 0.50
PRKCE Q02156 1/20 0.50
PRKCQ Q04759 1/20 0.50
PRKCD Q05655 1/20 0.50
CNR2 P34972 1/20 0.47

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
SCHEMBL380177 0.98 LMNA (0.82) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL839526 0.98 LMNA (0.82) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL8332902 0.98 LMNA (0.82) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL10797197 0.98 LMNA (0.82) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL20624 0.98 LMNA (0.82) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL270755 0.96 KDM4E (0.79) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL25356276 0.92 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL127956 0.92 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL3505466 0.92 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL25355124 0.92 KDM4E (0.74) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877952-B2 Pre-esterification of primary polyols to improve solubility in solvents used in the polyol process BATTELLE MEMORIAL INSTITUTE (US) 2014-11-04 US disclosed
US-8871960-B2 Preparation of esters and polyols by initial oxidative cleavage of fatty acids followed by esterification reactions BATTELLE MEMORIAL INSTITUTE (US) 2014-10-28 US disclosed
US-8859794-B2 Use of fatty acids as feed material in polyol process BATTELLE MEMORIAL INSTITUTE (US) 2014-10-14 US disclosed
US-8624047-B2 Solvent-less preparation of polyols by ozonolysis BATTELLE MEMORIAL INSTITUTE (US) 2014-01-07 US disclosed
US-8178703-B2 Methods for production of polyols from oils and their use in the production of polyesters and polyurethanes BATTELLE MEMORIAL INSTITUTE (US) 2012-05-15 US disclosed
US-20110269982-A1 USE OF FATTY ACIDS AS FEED MATERIAL IN POLYOL PROCESS BATTELLE MEMORIAL INSTITUTE (US) 2011-11-03 US disclosed
US-20110269979-A1 Preparation of Esters and Polyols by Initial Oxidative Cleavage of Fatty Acids Followed by Esterification Reactions BATTELLE MEMORIAL INSTITUTE (US) 2011-11-03 US disclosed
US-20110269978-A1 Solvent-less Preparation of Polyols by Ozonolysis BATTELLE MEMORIAL INSTITUTE (US) 2011-11-03 US disclosed
US-20110269981-A1 Pre-Esterification Of Primary Polyols To Improve Solubility In Solvents Used In The Polyol Process BATTELLE MEMORIAL INSTITUTE (US) 2011-11-03 US disclosed
US-20110237812-A1 METHODS FOR PRODUCTION OF POLYOLS FROM OILS AND THEIR USE IN THE PRODUCTION OF POLYESTERS AND POLYURETHANES BATTELLE MEMORIAL INSTITUTE (US) 2011-09-29 US disclosed
US-7994354-B2 Methods for production of polyols from oils and their use in the production of polyesters and polyurethanes BATTELLE MEMORIAL INSTITUTE (US) 2011-08-09 US disclosed
US-20090216040-A1 Methods For Production Of Polyols From Oils And Their Use In the Production of Polyesters and Polyurethanes BATTELLE MEMORIAL INSTITUTE (US) 2009-08-27 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 (6 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-20110269979-A1 Preparation of Esters and Polyols by Initial Oxidative Cleavage of Fatty Acids Followed by Esterification Reactions FASN, ELOVL1, ACSL1 KDM4E 2847/4885DUSP3 4526/4885MEN1 3758/4885
US-20110269978-A1 Solvent-less Preparation of Polyols by Ozonolysis MGLL, PUF60, DAGLA KDM4E 1511/4885DUSP3 3857/4885MEN1 2297/4885
US-20110269982-A1 USE OF FATTY ACIDS AS FEED MATERIAL IN POLYOL PROCESS FASN, ACSL1, ELOVL1 KDM4E 2221/4885DUSP3 4717/4885MEN1 3893/4885
US-20090216040-A1 Methods For Production Of Polyols From Oils And Their Use In the Production of Polyesters and Polyurethanes FASN, MGLL, PUF60 KDM4E 2368/4885DUSP3 4383/4885MEN1 3587/4885
US-20110237812-A1 METHODS FOR PRODUCTION OF POLYOLS FROM OILS AND THEIR USE IN THE PRODUCTION OF POLYESTERS AND POLYURETHANES FASN, MGLL, PUF60 KDM4E 2368/4885DUSP3 4383/4885MEN1 3587/4885
US-20110269981-A1 Pre-Esterification Of Primary Polyols To Improve Solubility In Solvents Used In The Polyol Process MGLL, FASN, ELOVL1 KDM4E 4227/4885DUSP3 4585/4885MEN1 2011/4885

“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.