SCHEMBL14844427

SCHEMBL14844427

CC(C)=C(C)CCC(C)CCO

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
ALOX15 P16050 1/20 0.46
TRPA1 O75762 1/20 0.32
PTPN1 P18031 1/20 0.31

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
SCHEMBL28762 0.78
SCHEMBL28191514 0.77 TSHR (0.32)
SCHEMBL11691078 0.75
SCHEMBL12189743 0.75 ALDH1A1 (0.46) ALDH1A1ALOX15TRPA1PTPN1
SCHEMBL11874957 0.75 TDP1 (0.30)
Ethylene Glycol SCHEMBL5930511 0.74 ALDH1A1 (0.55) ALDH1A1ALOX15TRPA1PTPN1
SCHEMBL11059751 0.74 ALDH1A1 (0.55) ALDH1A1ALOX15TRPA1PTPN1
SCHEMBL7045168 0.73 ALDH1A1 (0.50) ALDH1A1ALOX15TRPA1PTPN1
SCHEMBL7045172 0.73 ALDH1A1 (0.50) ALDH1A1ALOX15TRPA1PTPN1
SCHEMBL7046628 0.73 ALDH1A1 (0.50) ALDH1A1ALOX15TRPA1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2747886-B1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH & CIE (CH) 2018-11-14 EP disclosed
EP-2970067-B1 SELECTIVE HYDROGENATION OF ALDEHYDES WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH & CIE (CH) 2017-08-16 EP disclosed
US-9714263-B2 Selective hydrogenation of aldehydes with Ru/bidentate ligands complexes FIRMENICH SA (CH) 2017-07-25 US disclosed
US-20160039853-A1 SELECTIVE HYDROGENATION OF ALDEHYDES WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2016-02-11 US disclosed
EP-2970067-A1 SELECTIVE HYDROGENATION OF ALDEHYDES WITH RU/BIDENTATE LIGANDS COMPLEXES Firmenich SA (CH) 2016-01-20 EP disclosed
US-9090534-B2 Selective hydrogenation of aldehyde with ru/bidentate ligands complexes FIREMENICH SA (CH) 2015-07-28 US disclosed
US-9090534-B2 Selective hydrogenation of aldehyde with ru/bidentate ligands complexes FIREMENICH SA (CH) 2015-07-28 US disclosed
US-9090534-B2 Selective hydrogenation of aldehyde with ru/bidentate ligands complexes FIREMENICH SA (CH) 2015-07-28 US disclosed
WO-2014139854-A1 SELECTIVE HYDROGENATION OF ALDEHYDES WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2014-09-18 WO disclosed
US-20140243526-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2014-08-28 US disclosed
US-20140243526-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2014-08-28 US disclosed
US-20140243526-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2014-08-28 US disclosed
EP-2747886-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES Firmenich SA (CH) 2014-07-02 EP disclosed
WO-2013050297-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2013-04-11 WO disclosed
WO-2013050297-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES FIRMENICH SA (CH) 2013-04-11 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-20160039853-A1 SELECTIVE HYDROGENATION OF ALDEHYDES WITH RU/BIDENTATE LIGANDS COMPLEXES ADH5, ADH1A, ADH1C ALDH1A1 56/4885ALOX15 685/4885TRPA1 1185/4885
US-20140243526-A1 SELECTIVE HYDROGENATION OF ALDEHYDE WITH RU/BIDENTATE LIGANDS COMPLEXES ADH5, ADH1A, HAO2 ALDH1A1 40/4885ALOX15 1041/4885TRPA1 1502/4885

“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.