SCHEMBL19810191

SCHEMBL19810191

CC=CC=CCCOC(=O)CC(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.44
CNR1 P21554 7/20 0.44
PPARG P37231 2/20 0.44
PPARD Q03181 2/20 0.44
PPARA Q07869 2/20 0.44
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
PRKCA P17252 1/20 0.34
SOAT1 P35610 1/20 0.33
TRPA1 O75762 1/20 0.33
TRPV1 Q8NER1 1/20 0.33

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
SCHEMBL19810188 1.00 CNR2 (0.44) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810190 1.00 CNR2 (0.44) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810211 0.80 CNR2 (0.44) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810161 0.80 NAAA (0.42) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810163 0.80 NAAA (0.42) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810208 0.80 CNR2 (0.44) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810160 0.80 NAAA (0.42) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810210 0.80 CNR2 (0.44) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810230 0.79 CNR2 (0.42) CNR2CNR1PPARGPPARDPPARA
SCHEMBL19810233 0.79 CNR2 (0.42) CNR2CNR1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3490389-B1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RES INC (US) 2024-09-25 EP claimed
EP-3490389-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS Bedoukian Research, Inc. (US) 2019-06-05 EP claimed
US-20180027845-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 US claimed
WO-2018022580-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 WO claimed
EP-3490389-B1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RES INC (US) 2024-09-25 EP disclosed
US-10863758-B2 Fragrance and flavor compositions containing isomeric alkadienyl esters BEDOUKIAN RESEARCH, INC. (US) 2020-12-15 US disclosed
EP-3490389-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS Bedoukian Research, Inc. (US) 2019-06-05 EP disclosed
US-20180027845-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 US disclosed
WO-2018022580-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 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-20180027845-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS FADS2, FADS1, DHCR24 CNR2 1172/4885CNR1 1248/4885PPARG 453/4885
US-10863758-B2 Fragrance and flavor compositions containing isomeric alkadienyl esters FADS2, FADS1, DHCR24 CNR2 1172/4885CNR1 1248/4885PPARG 453/4885

“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.