SCHEMBL5533154

SCHEMBL5533154

CC(C)(C)C(=O)OC(CO)CO

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.73
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
FAAH O00519 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ELANE P08246 3/20 0.32
PRKCE Q02156 1/20 0.32
PRKCQ Q04759 1/20 0.32
PRKCD Q05655 1/20 0.32

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
SCHEMBL30271065 0.85 PRKCA (1.00) PRKCAPRKCEPRKCQPRKCD
SCHEMBL20149745 0.81 PRKCA (0.52) PRKCAMAPTMAPK1FAAHALDH1A1
SCHEMBL11231390 0.81 PRKCA (0.52) PRKCAMAPTMAPK1FAAHALDH1A1
SCHEMBL10267877 0.80 PRKCA (0.55) PRKCAALDH1A1ELANEPRKCD
SCHEMBL5517129 0.79 PRKCA (0.50) PRKCAMAPTMAPK1FAAHALDH1A1
SCHEMBL14700435 0.78 PRKCA (0.53) PRKCAELANE
SCHEMBL15257875 0.78 PRKCA (0.53) PRKCAELANE
SCHEMBL12371936 0.76 PRKCA (0.52) PRKCAELANEPRKCEPRKCD
SCHEMBL9001033 0.76 PRKCA (0.81) PRKCAALDH1A1ELANEPRKCEPRKCQ
SCHEMBL27669202 0.76 PRKCA (0.52) PRKCAELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. 2012-08-16 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-20070108405-A1 Compositions and methods for delivery of biologically active agents FH FAULDING & CO., LTD. (AU) 2007-05-17 US 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 (1 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-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES CNR2, CNR1, HRH4 PRKCA 1519/4885MAPT 2374/4885MAPK1 1208/4885

“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.