Eugenol

Eugenol

SCHEMBL1867012

C=CCc1ccc(O)c(OC)c1.CC=Cc1ccc(OCc2ccccc2)c(OC)c1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
ALOX5 P09917 3/20 0.57
CYP3A4 P08684 1/20 0.57
AR P10275 1/20 0.57
PTGS1 P23219 1/20 0.57
TRPM8 Q7Z2W7 1/20 0.57
TYR P14679 1/20 0.53
APP P05067 3/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
CA12 O43570 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA5A P35218 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51
PTGER4 P35408 2/20 0.51
PTGER2 P43116 2/20 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
Methyleugenol SCHEMBL8390318 0.88 ALDH1A1 (0.70) ALDH1A1ALOX5CYP3A4ARPTGS1
Methylisoeugenol SCHEMBL1869594 0.88 ALDH1A1 (0.70) ALDH1A1ALOX5CYP3A4ARPTGS1
Cis/Trans-Isoeugenol SCHEMBL2686821 0.87 TYR (0.67) ALDH1A1ALOX5CYP3A4ARPTGS1
Eugenol SCHEMBL1865810 0.87 ALOX5 (0.76) ALDH1A1ALOX5CYP3A4ARPTGS1
Isoeugenol SCHEMBL1865809 0.87 ALOX5 (0.76) ALDH1A1ALOX5CYP3A4ARPTGS1
Eugenol SCHEMBL16556301 0.85 ALOX5 (0.72) ALDH1A1ALOX5CYP3A4ARPTGS1
Eugenol SCHEMBL16556298 0.85 ALOX5 (0.72) ALDH1A1ALOX5CYP3A4ARPTGS1
SCHEMBL5802074 0.83 ALDH1A1 (0.78) ALDH1A1ALOX5CYP3A4ARPTGS1
SCHEMBL874505 0.83 ALDH1A1 (0.69) ALDH1A1ALOX5CYP3A4ARPTGS1
SCHEMBL891624 0.83 APP (0.65) ALDH1A1APPHPGDHTTKDM4E

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