SCHEMBL408541

SCHEMBL408541

C=CCOCC(O)COCC1COC(C)(C)O1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
CA2 P00918 4/20 0.41
CA1 P00915 2/20 0.41
CA7 P43166 2/20 0.41
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31
CYP2D6 P10635 1/20 0.30

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
SCHEMBL10905872 0.89 CA2 (0.49) ALDH1A1CA2CYP2D6
SCHEMBL46416 0.85 ALDH1A1 (0.56) ALDH1A1CA2
SCHEMBL9778093 0.85 ALDH1A1 (0.56) ALDH1A1CA2
SCHEMBL9580528 0.85 ALDH1A1 (0.56) ALDH1A1CA2
SCHEMBL11932963 0.85 ALDH1A1 (0.41) ALDH1A1CA2
SCHEMBL14317553 0.84 CA2 (0.45) ALDH1A1CA2
SCHEMBL11939691 0.83 CA2 (0.44) ALDH1A1CA2
SCHEMBL29342844 0.82 CA2 (0.37) ALDH1A1CA2
SCHEMBL12921172 0.82 CA2 (0.43) ALDH1A1CA2
SCHEMBL13326873 0.81 CA2 (0.45) ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151890-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2024-07-18 WO disclosed
EP-2939999-B1 HIGH-PURITY MONOALKENYL-CONTAINING GLYCERIN DERIVATIVE, AND METHOD FOR PRODUCING SAME DOW CORNING TORAY CO LTD (JP) 2018-03-07 EP disclosed
EP-2720999-B1 NOVEL LIPIDOMIMETIC COMPOUNDS AND USES THEREOF KONINKLIJKE PHILIPS NV (NL) 2017-08-23 EP disclosed
US-9663432-B2 High-purity monoalkenyl-containing glycerin derivative and method of manufacturing same DOW CORNING TORAY CO., LTD. (JP) 2017-05-30 US disclosed
US-9663432-B2 High-purity monoalkenyl-containing glycerin derivative and method of manufacturing same DOW CORNING TORAY CO., LTD. (JP) 2017-05-30 US disclosed
US-20160031781-A1 AGENT FOR IMPROVING TISSUE PENETRATION GENZYME CORPORATION (US) 2016-02-04 US disclosed
US-20160031781-A1 AGENT FOR IMPROVING TISSUE PENETRATION GENZYME CORPORATION (US) 2016-02-04 US disclosed
EP-2939999-A1 HIGH-PURITY MONOALKENYL-CONTAINING GLYCERIN DERIVATIVE, AND METHOD FOR PRODUCING SAME Dow Corning Toray Co., Ltd. (JP) 2015-11-04 EP disclosed
US-9061062-B2 Lipidomimetic compounds and uses thereof KONINKLIJKE PHILIPS N.V. (NL) 2015-06-23 US disclosed
US-9061062-B2 Lipidomimetic compounds and uses thereof KONINKLIJKE PHILIPS N.V. (NL) 2015-06-23 US disclosed
US-20120064147-A1 AGENT FOR IMPROVING TISSUE PENETRATION GENZYME CORPORATION (US) 2012-03-15 US disclosed
US-8076520-B2 Phosphatidyl oligoglycerols MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2011-12-13 US disclosed
US-20100280282-A1 PHOSPHATIDYL OLIGOGLYCEROLS MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2010-11-04 US disclosed
US-7709464-B2 Phosphatidyl oligoglycerols MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E. V. (DE) 2010-05-04 US disclosed
US-20090312440-A1 AGENT FOR IMPROVING TISSUE PENETRATION MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2009-12-17 US disclosed
US-20090312440-A1 AGENT FOR IMPROVING TISSUE PENETRATION MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2009-12-17 US disclosed
US-20090035358-A1 PHOSPHATIDYL OLIGOGLYCEROLS MAX-PLANCK-GESSELSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2009-02-05 US disclosed
US-7351428-B2 Phosphatidyl oligoglycerols MAX-PLANCK-GESSELSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2008-04-01 US disclosed
US-20080003277-A1 Agent for improving tissue penetration MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2008-01-03 US disclosed
US-20080003277-A1 Agent for improving tissue penetration MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSHAFTEN E.V. (DE) 2008-01-03 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-20080003277-A1 Agent for improving tissue penetration PGF, MMP8, MMP1 ALDH1A1 1823/4885CA2 1449/4885CA1 1662/4885
US-20100280282-A1 PHOSPHATIDYL OLIGOGLYCEROLS PHOSPHO1, SGMS2, LIPG ALDH1A1 3095/4885CA2 4175/4885CA1 4665/4885
US-20090312440-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 ALDH1A1 1823/4885CA2 1449/4885CA1 1662/4885
US-20090035358-A1 PHOSPHATIDYL OLIGOGLYCEROLS PHOSPHO1, SGMS2, LIPG ALDH1A1 3095/4885CA2 4175/4885CA1 4665/4885
US-20160031781-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 ALDH1A1 1823/4885CA2 1449/4885CA1 1662/4885
US-20120064147-A1 AGENT FOR IMPROVING TISSUE PENETRATION PGF, MMP8, MMP1 ALDH1A1 1823/4885CA2 1449/4885CA1 1662/4885

“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.