SCHEMBL2209837

SCHEMBL2209837

CCC=CCCC=CC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.47
ALDH1A1 P00352 6/20 0.43
CYP19A1 P11511 4/20 0.43
PPARG P37231 3/20 0.43
OXER1 Q8TDS5 3/20 0.43
MAPT P10636 3/20 0.43
RXRA P19793 2/20 0.43
FFAR1 O14842 2/20 0.43
PTGS1 P23219 3/20 0.41
F7 P08709 3/20 0.41
F3 P13726 3/20 0.41
KMT2A Q03164 3/20 0.41
PPARD Q03181 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
MEN1 O00255 2/20 0.38
CYP3A4 P08684 2/20 0.38
NR1I2 O75469 2/20 0.38
PTGS2 P35354 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 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
SCHEMBL3959907 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL2482053 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL4846639 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL2209835 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL28050942 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL4437387 0.91 ALDH1A1 (0.48) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL254292 0.85
SCHEMBL29098358 0.85 TRPA1 (0.35) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL400439 0.85
SCHEMBL5216645 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2742983-B1 Method for isolating fragrance and flavour compounds SYMRISE AG (DE) 2017-08-23 EP claimed
EP-2348014-B1 Unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INT FLAVORS & FRAGRANCES INC (US) 2017-05-10 EP claimed
EP-1642886-B1 Saturated and unsaturated N-Alkamides exhibiting taste and flavor enhancement effect in flavor compositions INT FLAVORS & FRAGRANCES INC (US) 2016-11-16 EP claimed
EP-2742983-A1 Method for isolating fragrance and flavour compounds Symrise AG (DE) 2014-06-18 EP claimed
EP-2348014-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions International Flavors & Fragrances Inc. (US) 2011-07-27 EP claimed
US-7794768-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2010-09-14 US claimed
US-7632531-B2 Alkyldienamides exhibiting taste and sensory effect in flavor compositions International Flavors & Fragnances Inc. (US) 2009-12-15 US claimed
US-20080317922-A1 SATURATED AND UNSATURATED N-ALKAMIDES EXHIBITING TASTE AND FLAVOR ENHANCEMENT EFFECT IN FLAVOR COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2008-12-25 US claimed
US-7427421-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2008-09-23 US claimed
EP-1642886-A2 Saturated and unsaturated N-Alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 2006-04-05 EP claimed
US-20060068071-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. 2006-03-30 US claimed
US-20060057268-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. 2006-03-16 US claimed
CN-104219966-B N- sulphonyl-amino acid derivative as food fragrance compound 奇华顿股份有限公司 2019-05-28 CN disclosed
CN-106220546-B N- acyl-proline derivative as food fragrance compound 奇华顿股份有限公司 2018-11-30 CN disclosed
CN-106631943-B N- as food fragrance compound is acylated methionine derivatives 奇华顿股份有限公司 2018-11-09 CN disclosed
CN-104219965-B N-acyl derivatives of gamma amino-butyric and β alanine as food perfuming compounds 奇华顿股份有限公司 2018-10-12 CN disclosed
US-7427421-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2008-09-23 US disclosed
EP-1642886-A2 Saturated and unsaturated N-Alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 2006-04-05 EP disclosed
US-20060068071-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. 2006-03-30 US disclosed
US-20060057268-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. 2006-03-16 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-20080317922-A1 SATURATED AND UNSATURATED N-ALKAMIDES EXHIBITING TASTE AND FLAVOR ENHANCEMENT EFFECT IN FLAVOR COMPOSITIONS TAS2R8, TAS2R3, TAS2R5 PPARA 1392/4885ALDH1A1 2086/4885CYP19A1 4515/4885

“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.