SCHEMBL28814217

SCHEMBL28814217

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.59
PRKCE Q02156 1/20 0.59
PRKCQ Q04759 1/20 0.59
PRKCD Q05655 1/20 0.59
LMNA P02545 3/20 0.59
FAAH O00519 3/20 0.56
MAPT P10636 3/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
DGKA P23743 1/20 0.55
TERT O14746 3/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2C19 P33261 2/20 0.54
BLM P54132 2/20 0.54
HSD17B10 Q99714 2/20 0.54
FABP4 P15090 2/20 0.54
PTPN1 P18031 2/20 0.54
PPARG P37231 2/20 0.54

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
SCHEMBL1720660 1.00 PRKCA (0.59) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL1720658 1.00 PRKCA (0.59) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL28580959 0.97 PRKCA (0.56) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL29521415 0.97 PRKCA (0.56) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL28581640 0.97 PRKCA (0.56) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL27982736 0.95 ALDH1A1 (0.63) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL27982735 0.91 ALDH1A1 (0.69) LMNAFAAHMAPTALDH1A1HPGD
SCHEMBL27982737 0.91 ALDH1A1 (0.69) LMNAFAAHMAPTALDH1A1HPGD
SCHEMBL12614545 0.90 ALDH1A1 (0.56) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL12614543 0.90 ALDH1A1 (0.56) PRKCAPRKCEPRKCQPRKCDLMNA

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
CN-101909729-B Ozonolysis reactions in liquid CO2 and CO2-expanded solvents UNIVERSITY OF KANSAS (US) 2014-10-22 CN disclosed