SCHEMBL406117

SCHEMBL406117

CC(=O)CCC(=O)OCC(CO)OC(=O)CCC(C)=O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 7/20 0.63
PRKCE Q02156 2/20 0.63
PRKCQ Q04759 2/20 0.63
PRKCD Q05655 2/20 0.63
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL402173 0.90 ALDH1A1 (0.59) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL402501 0.86 MAPT (0.57) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL14453250 0.85 ALDH1A1 (0.59) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL13218896 0.85 ALDH1A1 (0.59) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL77143 0.83 PRKCA (0.75) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL5026886 0.83 PRKCA (0.60) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL2927505 0.83 PRKCA (0.75) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL16580778 0.82 ALDH1A1 (0.51) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL2197625 0.80 PRKCA (0.87) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL29862879 0.80 PRKCA (0.87) PRKCAPRKCEPRKCQPRKCDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906961-B2 Glycerol levulinate ketals and their use in the manufacture of polyurethanes, and polyurethanes formed therefrom SEGETIS, INC. (US) 2014-12-09 US disclosed
US-20130303648-A1 GLYCEROL LEVULINATE KETALS AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES, AND POLYURETHANES FORMED THEREFROM GFBIOCHEMICALS LIMITED (MT) 2013-11-14 US disclosed
US-8492433-B2 Glycerol levulinate ketals and their use in the manufacture of polyurethanes, and polyurethanes formed therefrom SEGETIS, INC. (US) 2013-07-23 US disclosed
EP-1954140-B1 GLYCEROL LEVULINATE KETALS AND THEIR USE SEGETIS INC (US) 2013-05-29 EP disclosed
US-20120196947-A1 GLYCEROL LEVULINATE KETALS AND THEIR USE IN THE MANUFACTURE OF POLYURETHANES, AND POLYURETHANES FORMED THEREFROM SEGETIS, INC. (US) 2012-08-02 US disclosed
US-8178701-B2 Glycerol levulinate ketals and their use SEGETIS, INC. (US) 2012-05-15 US disclosed
US-20120021962-A1 GLYCEROL LEVULINATE KETALS AND THEIR USE SEGETIS, INC. (US) 2012-01-26 US disclosed
US-8053468-B2 Glycerol levulinate ketals and their use SEGETIS, INC. (US) 2011-11-08 US disclosed
US-20080242721-A1 plasticizers; polylactones and polyurethanes prepared from them; substituted oxymethylene moiety attached to the dioxolane ring is predominantly in the cis configuration relative to the configuration of the side chain bearing the carboxyl group AROMAGEN CORPORATION (US) 2008-10-02 US disclosed
EP-1954140-A2 GLYCEROL LEVULINATE KETALS AND THEIR USE Aromagen Corporation (US) 2008-08-13 EP disclosed
WO-2007062118-A2 GLYCEROL LEVULINATE KETALS AND THEIR USE AROMAGEN CORPORATION (US) 2007-05-31 WO 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 (2 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-20080242721-A1 plasticizers; polylactones and polyurethanes prepared from them; substituted oxymethylene moiety attached to the dioxolane ring is predominantly in the cis configuration relative to the configuration of the side chain bearing the carboxyl group GK, FTO, DGKK PRKCA 62/4885PRKCE 124/4885PRKCQ 396/4885
US-20120021962-A1 GLYCEROL LEVULINATE KETALS AND THEIR USE GK, GRIK5, KHK PRKCA 351/4885PRKCE 280/4885PRKCQ 690/4885

“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.