Triacetin

Triacetin

SCHEMBL3680247

CC(=O)OCC(COC(C)=O)OC(C)=O.CCCCCCCOC(C)=O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
PRKCA P17252 3/20 0.56
LMNA P02545 1/20 0.51
TSHR P16473 2/20 0.47
NAAA Q02083 1/20 0.47
ADRA1D P25100 1/20 0.47
PTAFR P25105 1/20 0.47
HTR1D P28221 1/20 0.47
HTR2C P28335 1/20 0.47
ADRA1B P35368 1/20 0.47
DRD3 P35462 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47

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
Triacetin SCHEMBL8664971 0.93 PRKCA (0.63) ALDH1A1PRKCALMNA
SCHEMBL8435468 0.92 ADRA1D (0.55) ALDH1A1PRKCALMNAADRA1DPTAFR
Triacetin SCHEMBL17821531 0.92 PRKCA (0.55) ALDH1A1PRKCALMNAADRA1DPTAFR
SCHEMBL8438758 0.92 ADRA1D (0.55) ALDH1A1PRKCALMNAADRA1DPTAFR
SCHEMBL10894210 0.92 ADRA1D (0.55) ALDH1A1PRKCALMNAADRA1DPTAFR
SCHEMBL10824976 0.92 ADRA1D (0.55) ALDH1A1PRKCALMNAADRA1DPTAFR
Triacetin SCHEMBL9300248 0.89 PRKCA (0.69) ALDH1A1PRKCALMNA
Cetyl Alcohol SCHEMBL8600510 0.86 PRKCA (0.60) ALDH1A1PRKCALMNATSHR
Cetostearyl Alcohol SCHEMBL27687492 0.86 PRKCA (0.60) ALDH1A1PRKCALMNATSHR
Triacetin SCHEMBL4949915 0.85 ALDH1A1 (0.48) ALDH1A1PRKCALMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687093-B1 Local topical administration formulations containing indoxacarb FMC CORP (US) 2020-07-22 EP disclosed
US-9968617-B2 Local topical administration formulations containing indoxacarb E. I. DU PONT DE NEMOURS AND COMPANY (US) 2018-05-15 US disclosed
EP-2066179-B1 FORMULATIONS CONTAINING INDOXACARB FOR LOCAL TOPICAL ADMINISTRATION DU PONT (US) 2016-06-22 EP disclosed
US-20160008370-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB E.I. DU PONT DE NEMOURS AND COMPANY (US) 2016-01-14 US disclosed
EP-2687093-A1 Local topical administration formulations containing indoxacarb E. I. Du Pont de Nemours and Company (US) 2014-01-22 EP disclosed
US-20130345210-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2013-12-26 US disclosed
US-8475818-B2 Local topical administration formulations containing indoxacarb E. I. DE PONT DE NEMOURS AND COMPANY (US) 2013-07-02 US disclosed
US-20100099668-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB FMC CORPORATION 2010-04-22 US disclosed
EP-2066179-A2 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-06-10 EP disclosed
WO-2008030385-A2 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-13 WO 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 (3 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-20130345210-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB IDO1, MMP1, IDO2 ALDH1A1 782/4885PRKCA 3625/4885LMNA 3923/4885
US-20100099668-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB IDO1, MMP1, IDO2 ALDH1A1 782/4885PRKCA 3625/4885LMNA 3923/4885
US-20160008370-A1 LOCAL TOPICAL ADMINISTRATION FORMULATIONS CONTAINING INDOXACARB IDO1, MMP1, IDO2 ALDH1A1 782/4885PRKCA 3625/4885LMNA 3923/4885

“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.