SCHEMBL8438758

SCHEMBL8438758

CCCCCCCCCCCCCCCCCCOCC(COC(C)=O)OC(C)=O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.55
PTAFR P25105 1/20 0.55
HTR1D P28221 1/20 0.55
HTR2C P28335 1/20 0.55
ADRA1B P35368 1/20 0.55
DRD3 P35462 1/20 0.55
TMEM97 Q5BJF2 1/20 0.55
PRKCA P17252 3/20 0.55
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
PLA2G2C Q5R387 1/20 0.49
CES2 O00748 1/20 0.49
USP2 O75604 1/20 0.46

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
SCHEMBL10894210 1.00 ADRA1D (0.55) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL8435468 1.00 ADRA1D (0.55) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10824976 1.00 ADRA1D (0.55) ADRA1DPTAFRHTR1DHTR2CADRA1B
Triacetin SCHEMBL17821531 0.97 PRKCA (0.55) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL13449715 0.93 ALDH1A1 (0.53) ADRA1DPTAFRHTR1DHTR2CADRA1B
Triacetin SCHEMBL3680247 0.92 ALDH1A1 (0.57) ADRA1DPTAFRHTR1DHTR2CADRA1B
Triacetin SCHEMBL8664971 0.91 PRKCA (0.63) PRKCAALDH1A1LMNA
SCHEMBL1506792 0.91 PRKCA (0.61) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL1506794 0.91 PRKCA (0.61) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL5017334 0.89 PRKCA (0.47) ADRA1DPTAFRHTR1DHTR2CADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370516-B2 Bio based plasticizer with improved properties and processing characteristics of polymer FINE ORGANICS INDUSTRIES PVT LTD. (IN) 2019-08-06 US disclosed
US-20180037719-A1 A BIO BASED PLASTICIZER WITH IMPROVED PROPERTIES AND PROCESSING CHARACTERISTICS OF POLYMER FINE ORGANICS INDUSTRIES PVT LTD. (IN) 2018-02-08 US disclosed
EP-0679337-B1 Cheese coating composition and method for producing protective coatings on cheese DANISCO (DK) 1999-12-22 EP disclosed
US-5516536-A ACETIC ESTERS OF LONG CHAIN FATTY ACID MONOGLYCERIDES DANISCO A/S (DK) 1996-05-14 US disclosed
EP-0679337-A2 Cheese coating composition and method for producing protective coatings on cheese DANISCO A/S (DK) 1995-11-02 EP disclosed
WO-1992001386-A1 REDUCED CALORIE CONFECTIONERY COMPOSITIONS NABISCO, INC. (US) 1992-02-06 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 (2 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-20180037719-A1 A BIO BASED PLASTICIZER WITH IMPROVED PROPERTIES AND PROCESSING CHARACTERISTICS OF POLYMER PHOSPHO1, ABHD5, AGPAT5 ADRA1D 1073/4885PTAFR 2543/4885HTR1D 2078/4885
US-10370516-B2 Bio based plasticizer with improved properties and processing characteristics of polymer ABHD5, PHOSPHO1, AGPAT5 ADRA1D 1293/4885PTAFR 2534/4885HTR1D 2148/4885

“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.