SCHEMBL3169682

SCHEMBL3169682

CCCC(C)=CCOC(C)=O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
ALOX15 P16050 1/20 0.66
PTPN1 P18031 1/20 0.53
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TRPV1 Q8NER1 2/20 0.38
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
PGGT1B P53609 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
SCHEMBL3169676 1.00 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL9953013 1.00 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL9609320 0.92 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL5150363 0.88 ALDH1A1 (0.61) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL5150357 0.88 ALDH1A1 (0.61) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL5152477 0.83 ALDH1A1 (0.47) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL5152482 0.83 ALDH1A1 (0.47) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL23036813 0.83 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL23036807 0.83 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10
SCHEMBL21518288 0.83 ALDH1A1 (0.66) ALDH1A1ALOX15PTPN1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP claimed
EP-2773430-B1 PERFUMING COMPOSITIONS AND USES THEREOF FIRMENICH & CIE (CH) 2019-10-09 EP claimed
EP-2771071-B1 PERFUMING COMPOSITIONS AND USES THEREOF FIRMENICH & CIE (CH) 2019-08-07 EP claimed
CN-104125847-B Perfume composition and application thereof 弗门尼舍有限公司 2017-09-08 CN claimed
US-9428712-B2 Perfuming compositions and uses thereof FIRMENICH SA (CH) 2016-08-30 US claimed
CN-104114147-B Perfume composition and uses thereof FIRMENICH S.A. (CH) 2016-04-13 CN claimed
US-9296978-B2 Perfuming compositions and uses thereof FIRMENICH SA (CH) 2016-03-29 US claimed
CN-102933193-B Perfuming composition and use thereof FIRMENICH & CIE 2015-06-17 CN claimed
US-8822404-B2 Perfuming compositions and uses thereof FIRMENICH SA (CH) 2014-09-02 US claimed
EP-1188433-B1 Use of unsaturated esters as perfuming ingredients FIRMENICH & CIE (CH) 2007-01-03 EP claimed
US-6924262-B2 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2005-08-02 US claimed
US-20020055455-A1 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2002-05-09 US claimed
EP-1188433-A2 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2002-03-20 EP claimed
CN-122028974-A Ribonucleic acid-based microcapsules 弗门尼舍有限公司 2026-05-12 CN disclosed
US-12624309-B2 Enol ether properfume FIRMENICH SA (CH) 2026-05-12 US disclosed
US-12616948-B2 Polyamide microcapsules FIRMENICH SA (CH) 2026-05-05 US disclosed
US-6924262-B2 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2005-08-02 US disclosed
US-20020055455-A1 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2002-05-09 US disclosed
EP-1188433-A2 Use of unsaturated esters as perfuming ingredients FIRMENICH SA (CH) 2002-03-20 EP disclosed
US-3949007-A METAL HYDROXIDE OR ALKOXIDE CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 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 (3 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-20020055455-A1 Use of unsaturated esters as perfuming ingredients CYP2E1, ELOVL1, ELOVL5 ALDH1A1 744/4885ALOX15 21/4885PTPN1 4765/4885
US-12616948-B2 Polyamide microcapsules HDHD5, DDC, USP39 ALDH1A1 4007/4885ALOX15 3255/4885PTPN1 2679/4885
US-12624309-B2 Enol ether properfume CYP2E1, CBR1, ADH5 ALDH1A1 33/4885ALOX15 139/4885PTPN1 4255/4885

“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.