Eugenyl Acetate

Eugenyl Acetate

SCHEMBL1870376

C/C=C/c1ccc(OC(C)=O)c(OC)c1.C=CCc1ccc(OC(C)=O)c(OC)c1

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.79
MAOA P21397 1/20 0.61
MAOB P27338 1/20 0.61
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
CYP3A4 P08684 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
JUN P05412 1/20 0.57
NFKB1 P19838 1/20 0.57
ALDH1A1 P00352 4/20 0.56
PPARA Q07869 2/20 0.56
PPARG P37231 1/20 0.56
PPARD Q03181 1/20 0.56
ALOX5 P09917 3/20 0.56
VCP P55072 1/20 0.53
POLB P06746 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 1/20 0.51
PRSS1 P07477 1/20 0.51

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
Eugenyl Acetate SCHEMBL1870377 1.00 PTGS1 (0.79) PTGS1MAOAMAOBKMT2AMEN1
Eugenyl Acetate SCHEMBL4257332 0.92 PTGS1 (0.73) PTGS1MAOAMAOBKMT2AMEN1
Eugenyl Acetate SCHEMBL4257336 0.92 PTGS1 (0.73) PTGS1MAOAMAOBKMT2AMEN1
Eugenyl Acetate SCHEMBL29802968 0.89 PTGS1 (1.00) PTGS1MAOAMAOBKMT2AMEN1
Eugenyl Acetate SCHEMBL14764089 0.89 PTGS1 (1.00) PTGS1MAOAMAOBKMT2AMEN1
Eugenyl Acetate SCHEMBL112232 0.89 PTGS1 (1.00) PTGS1MAOAMAOBKMT2AMEN1
Methyleugenol SCHEMBL27082228 0.87 ALDH1A1 (0.73) PTGS1MAOAMAOBKMT2AMEN1
SCHEMBL29833106 0.86 JUN (0.75) KMT2AMEN1L3MBTL1JUNNFKB1
SCHEMBL580590 0.86 JUN (0.75) KMT2AMEN1L3MBTL1JUNNFKB1
SCHEMBL30136400 0.86 JUN (0.75) KMT2AMEN1L3MBTL1JUNNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496682-A1 DELIVERY PARTICLE The Procter & Gamble Company (US) 2012-09-12 EP disclosed
WO-2011056935-A1 DELIVERY PARTICLE THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed