SCHEMBL3269985

SCHEMBL3269985

CCOC(=O)OC/C=C(\C)CCC=C(C)C

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.69
ALOX15 P16050 1/20 0.69
TRPV1 Q8NER1 2/20 0.56
FNTA P49354 2/20 0.52
FNTB P49356 2/20 0.52
PGGT1B P53609 1/20 0.52
KMT2A Q03164 1/20 0.48

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
SCHEMBL4962981 1.00 ALDH1A1 (0.69) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL28538300 0.93 ALDH1A1 (0.79) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL7220410 0.93 ALDH1A1 (0.79) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL788923 0.91 ALDH1A1 (0.76) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL12986604 0.85 ALDH1A1 (0.67) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL12986607 0.85 ALDH1A1 (0.67) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL10988858 0.84 ALDH1A1 (0.71) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL21051958 0.84 ALDH1A1 (0.71) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL10988863 0.84 ALDH1A1 (0.71) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL6950547 0.84 ALDH1A1 (0.61) ALDH1A1ALOX15TRPV1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030036489-A1 Consumable composition comprising perfumed particles and article containing the same THE PROCTER & GAMBLE COMPANY 2003-02-20 US claimed
WO-2002090479-A1 PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2002090481-A1 COMPOSITIONS AND ARTICLES FOR EFFECTIVE DEPOSITION OF PERFUME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
EP-1920042-B1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCED PROPERTIES HENKEL AG & CO KGAA (DE) 2010-06-23 EP disclosed
EP-2046929-A1 LIQUID SUPPORT Henkel AG & Co. KGaA (DE) 2009-04-15 EP disclosed
EP-2038391-A1 WASHING, CLEANING AND CARE PRODUCTS Henkel AG & Co. KGaA (DE) 2009-03-25 EP disclosed
WO-2008116509-A1 CLEANING AGENT HENKEL AG & CO. KGAA (DE) 2008-10-02 WO disclosed
US-20080221003-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-11 US disclosed
US-20080207481-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-28 US disclosed
US-20080207476-A1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCE PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-28 US disclosed
EP-1928992-A1 CONSUMER PRODUCTS HAVING VARYING ODORS Henkel AG & Co. KGaA (DE) 2008-06-11 EP disclosed
US-4525364-A FOODS, MEDICINE, COSMETICS, DETERGENTS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-06-25 US disclosed
US-4522765-A Di(7-octenyl) carbonate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-06-11 US disclosed
US-4515712-A PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-05-07 US disclosed
US-4490544-A ENHANCING TEH AROMA OR TASTE OF FOODSTUFFS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-12-25 US disclosed
US-4454111-A Prenyl methyl carbonate and organoleptic uses thereof INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-06-12 US disclosed
US-4447365-A ORGANOLEPTIC AGENT INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-05-08 US disclosed
US-4446157-A Prenyl methyl carbonate and organoleptic uses thereof INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-05-01 US disclosed
US-4420472-A TOOTHPASTES, MOUTHWASHES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-12-13 US disclosed
US-4390463-A Process for augmenting or enhancing the aroma of perfume compositions and colognes utilizing alkyl, aralkyl, and bicycloalkyl methyl carbonates INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-06-28 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 (1 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-20080207476-A1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCE PROPERTIES DSC1, DSG1, PIEZO1 ALDH1A1 3408/4885ALOX15 1395/4885TRPV1 26/4885

“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.