Chavibetol

Chavibetol

SCHEMBL6455963

C=CCc1ccc(OC)c(O)c1.Oc1ccccc1

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.63
ALDH1A1 P00352 3/20 0.63
CYP3A4 P08684 3/20 0.63
PTGS1 P23219 2/20 0.63
AR P10275 1/20 0.63
TRPM8 Q7Z2W7 1/20 0.63
GABRA1 P14867 3/20 0.61
GABRB2 P47870 3/20 0.61
PPARA Q07869 2/20 0.59
PPARG P37231 1/20 0.59
PPARD Q03181 1/20 0.59
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CNR2 P34972 1/20 0.53
XDH P47989 1/20 0.51
GAA P10253 2/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 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
Chavibetol SCHEMBL901503 0.91 ALOX5 (0.75) ALOX5ALDH1A1CYP3A4PTGS1AR
Chavibetol SCHEMBL29752081 0.91 ALOX5 (0.75) ALOX5ALDH1A1CYP3A4PTGS1AR
Eugenol SCHEMBL8900744 0.88 ALDH1A1 (0.82) ALOX5ALDH1A1CYP3A4PTGS1AR
Eugenol SCHEMBL5705086 0.88 ALDH1A1 (0.82) ALOX5ALDH1A1CYP3A4PTGS1AR
Phenol SCHEMBL15272898 0.85 ALDH1A1 (0.63) ALOX5ALDH1A1CYP3A4PTGS1AR
Methyleugenol SCHEMBL26688181 0.82 ALDH1A1 (0.73) ALOX5ALDH1A1CYP3A4PTGS1AR
Phenol SCHEMBL27678071 0.81 GAA (0.57) CYP3A4MEN1KMT2AGAAKDM4E
Eugenol SCHEMBL28883151 0.81 ALDH1A1 (0.93) ALOX5ALDH1A1CYP3A4PTGS1AR
Eugenol SCHEMBL11239686 0.81 ALDH1A1 (0.85) ALOX5ALDH1A1CYP3A4PTGS1AR
SCHEMBL29353656 0.80 TTR (0.66) ALOX5ALDH1A1CYP3A4PTGS1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050053678-A1 Methods and compositions for betel nut chewing gum HERBALSCIENCE NUTRACEUTICALS, INC. 2005-03-10 US disclosed