SCHEMBL7045172

SCHEMBL7045172

CC=C(C)CCC(C)CCO

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
ALOX15 P16050 1/20 0.50
PTPN1 P18031 1/20 0.38
TRPA1 O75762 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
SCHEMBL7046628 1.00 ALDH1A1 (0.50) ALDH1A1ALOX15PTPN1TRPA1
SCHEMBL7045168 1.00 ALDH1A1 (0.50) ALDH1A1ALOX15PTPN1TRPA1
SCHEMBL2005331 0.78 PTPN1 (0.31) PTPN1
SCHEMBL26977317 0.78 ALDH1A1 (0.46) ALDH1A1ALOX15PTPN1TRPA1
SCHEMBL2005328 0.78 PTPN1 (0.31) PTPN1
SCHEMBL28762 0.76
SCHEMBL18676053 0.75
Propene SCHEMBL20874089 0.74 ALOX15 (0.52) ALDH1A1ALOX15PTPN1TRPA1
SCHEMBL28580097 0.74
SCHEMBL14844427 0.73 ALDH1A1 (0.46) ALDH1A1ALOX15PTPN1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1029841-B1 6-Substituted 3-methyloct-6-enols GIVAUDAN SA (CH) 2003-04-09 EP claimed
US-6297211-B1 PERFUMES AND BRANCHED UNSATURATED ALCOHOLS GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2001-10-02 US claimed
EP-1029841-A1 6-Substituted 3-methyloct-6-enols Givaudan Roure (International) S.A. (CH) 2000-08-23 EP claimed
CN-111194301-B Synthesis of aliphatic alcohols as fragrance chemicals 巴斯夫欧洲公司 2023-12-19 CN disclosed
EP-3694829-B1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS BASF SE (DE) 2023-12-13 EP disclosed
US-11286224-B2 Synthesis of aliphatic alcohols as aroma chemicals BASF SE (DE) 2022-03-29 US disclosed
US-20210188748-A1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS BASF SE (DE) 2021-06-24 US disclosed
EP-3694829-A1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS BASF SE (DE) 2020-08-19 EP disclosed
CN-111194301-A Synthesis of aliphatic alcohols as fragrance chemicals 巴斯夫欧洲公司 2020-05-22 CN disclosed
WO-2019072669-A1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS BASF SE (DE) 2019-04-18 WO disclosed
EP-3470388-A1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS BASF SE (DE) 2019-04-17 EP disclosed
CN-1173907-C 6-substd. 3-methyl-oct-6-enol ����µ�-³��(����)�ɷݹ�˾ 2004-11-03 CN disclosed
EP-1029841-B1 6-Substituted 3-methyloct-6-enols GIVAUDAN SA (CH) 2003-04-09 EP disclosed
US-6297211-B1 PERFUMES AND BRANCHED UNSATURATED ALCOHOLS GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2001-10-02 US disclosed
US-6297211-B1 PERFUMES AND BRANCHED UNSATURATED ALCOHOLS GIVAUDAN ROURE (INTERNATIONAL) SA (CH) 2001-10-02 US disclosed
CN-1266838-A 6-substd. 3-methyl-oct-6-enol GIVAUDAN ROURE INT (CH) 2000-09-20 CN disclosed
EP-1029841-A1 6-Substituted 3-methyloct-6-enols Givaudan Roure (International) S.A. (CH) 2000-08-23 EP disclosed
EP-1029841-A1 6-Substituted 3-methyloct-6-enols Givaudan Roure (International) S.A. (CH) 2000-08-23 EP 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-20210188748-A1 SYNTHESIS OF ALIPHATIC ALCOHOLS AS AROMA CHEMICALS ADH1A, ADH1C, ADH5 ALDH1A1 4/4885ALOX15 103/4885PTPN1 4859/4885
US-11286224-B2 Synthesis of aliphatic alcohols as aroma chemicals ADH1A, ADH1C, ADH5 ALDH1A1 4/4885ALOX15 103/4885PTPN1 4859/4885

“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.