SCHEMBL19810145

SCHEMBL19810145

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.40
MGLL Q99685 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CNR1 P21554 5/20 0.39
MAPT P10636 2/20 0.39
THRB P10828 1/20 0.39
SOAT1 P35610 1/20 0.37
FASN P49327 1/20 0.36
CNR2 P34972 6/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
DNM1 Q05193 1/20 0.34
BLM P54132 1/20 0.33
NR1I2 O75469 1/20 0.33
PGR P06401 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PTGS2 P35354 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
SCHEMBL19810144 1.00 DGKA (0.40) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810146 1.00 DGKA (0.40) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810148 0.90 DGKA (0.50) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810147 0.90 DGKA (0.50) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810149 0.90 DGKA (0.50) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810240 0.88 DGKA (0.58) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810236 0.88 DGKA (0.58) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810239 0.88 DGKA (0.58) DGKAMGLLALDH1A1CNR1MAPT
SCHEMBL19810160 0.85 NAAA (0.42) MGLLALDH1A1CNR1MAPTTHRB
SCHEMBL19810161 0.85 NAAA (0.42) MGLLALDH1A1CNR1MAPTTHRB

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 10 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
US-10863758-B2 Fragrance and flavor compositions containing isomeric alkadienyl esters BEDOUKIAN RESEARCH, INC. (US) 2020-12-15 US 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
WO-2018022580-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 WO disclosed
US-20180027845-A1 FRAGRANCE AND FLAVOR COMPOSITIONS CONTAINING ISOMERIC ALKADIENYL ESTERS BEDOUKIAN RESEARCH, INC. (US) 2018-02-01 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 (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 DGKA 795/4885MGLL 482/4885ALDH1A1 42/4885
US-10863758-B2 Fragrance and flavor compositions containing isomeric alkadienyl esters FADS2, FADS1, DHCR24 DGKA 795/4885MGLL 482/4885ALDH1A1 42/4885

“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.