SCHEMBL4846639

SCHEMBL4846639

CCC=CCC/C=C/C(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
SCHEMBL2209837 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL3959907 1.00 PPARA (0.47) PPARAALDH1A1CYP19A1PPARGOXER1
SCHEMBL2482053 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 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
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