SCHEMBL603757

SCHEMBL603757

COC(=O)O[C@H]1CO[C@H]2[C@@H]1OC[C@H]2OC(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 16/20 0.53
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL14007775 1.00 BCHE (0.53) BCHEALDH1A1
SCHEMBL603689 0.94 BCHE (0.49) BCHE
SCHEMBL11303679 0.94 BCHE (0.49) BCHE
SCHEMBL13418768 0.91 BCHE (0.46) BCHE
SCHEMBL602195 0.91 BCHE (0.49) BCHE
SCHEMBL14007774 0.91 BCHE (0.46) BCHE
SCHEMBL14007778 0.88 BCHE (0.51) BCHEALDH1A1
SCHEMBL31538809 0.85 BCHE (0.71) BCHEALDH1A1
SCHEMBL15890434 0.83 BCHE (0.50) BCHE
SCHEMBL18608284 0.82 BCHE (0.45) BCHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2949654-B1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S FUNDACIÓN TECNALIA RES & INNOVATION (ES) 2017-08-09 EP disclosed
US-9540390-B2 Method for manufacturing 1,4:3,6-dianhydrohexitol di(alkyl carbonate)s Fundacion Technalia Research & Innovation (ES) 2017-01-10 US disclosed
US-9540390-B2 Method for manufacturing 1,4:3,6-dianhydrohexitol di(alkyl carbonate)s Fundacion Technalia Research & Innovation (ES) 2017-01-10 US disclosed
US-9540390-B2 Method for manufacturing 1,4:3,6-dianhydrohexitol di(alkyl carbonate)s Fundacion Technalia Research & Innovation (ES) 2017-01-10 US disclosed
US-20160326185-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND COMPANY 2016-11-10 US disclosed
US-20160326185-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND COMPANY 2016-11-10 US disclosed
US-20160326185-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND COMPANY 2016-11-10 US disclosed
US-9422304-B2 Synthesis of isohexide dicarbamates and derivatives thereof ARCHER DANIELS MIDLAND COMPANY (US) 2016-08-23 US disclosed
EP-3008072-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF Archer-Daniels-Midland Company (US) 2016-04-20 EP disclosed
US-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND CO (US) 2016-03-24 US disclosed
US-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND CO (US) 2016-03-24 US disclosed
US-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND CO (US) 2016-03-24 US disclosed
EP-2949654-A1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S FUNDACIÓN TECNALIA RESEARCH & INNOVATION (ES) 2015-12-02 EP disclosed
US-20150336978-A1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S FUNDACION TECNALIA RESEARCH & INNOVATION (ES) 2015-11-26 US disclosed
US-20150336978-A1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S FUNDACION TECNALIA RESEARCH & INNOVATION (ES) 2015-11-26 US disclosed
US-20150336978-A1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S FUNDACION TECNALIA RESEARCH & INNOVATION (ES) 2015-11-26 US disclosed
WO-2014200637-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND COMPANY (US) 2014-12-18 WO disclosed
US-8399601-B2 Method for preparing a dialkyl carbonate of dianhydrohexitol ROQUETTE FRERES (FR) 2013-03-19 US disclosed
US-20120041169-A1 METHOD FOR PREPARING A DIALKYL CARBONATE OF DIANHYDROHEXITOL ROQUETTE FRERES (FR) 2012-02-16 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 (4 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-20120041169-A1 METHOD FOR PREPARING A DIALKYL CARBONATE OF DIANHYDROHEXITOL TREH, DCXR, ADH1C BCHE 359/4885ALDH1A1 1055/4885
US-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF PRKCA, PRKCE, PRKCI BCHE 1011/4885ALDH1A1 3338/4885
US-20160326185-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF PRKCA, PRKCE, PRKCI BCHE 1011/4885ALDH1A1 3338/4885
US-20150336978-A1 IMPROVED METHOD FOR MANUFACTURING 1,4:3,6-DIANHYDROHEXITOL DI(ALKYL CARBONATE)S DCXR, ADH1C, OSTC BCHE 2135/4885ALDH1A1 1085/4885

“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.