SCHEMBL28429014

SCHEMBL28429014

CCCCCC(=O)OC(C)OOCC(CC)OOC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
PRKCA P17252 5/20 0.44
PRKCE Q02156 2/20 0.44
PRKCQ Q04759 2/20 0.44
PRKCD Q05655 2/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
LPAR3 Q9UBY5 3/20 0.37
LPAR1 Q92633 2/20 0.37
ENPP2 Q13822 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 1/20 0.36

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
SCHEMBL94108 0.85 LMNA (0.56) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL27968565 0.80 LMNA (0.49) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL28423500 0.78 CA2 (0.36) MAPK1
SCHEMBL20956955 0.77 LMNA (0.47) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL20298383 0.76 LMNA (0.43) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL474072 0.74 LMNA (0.58) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL2419064 0.74 LMNA (0.58) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL311452 0.74 LMNA (0.40) LMNAALDH1A1MAPTMAPK1
SCHEMBL187385 0.74 LMNA (0.53) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL2829468 0.74 LMNA (0.53) LMNAPRKCAPRKCEPRKCQPRKCD

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-111386098-A Delivery system for peroxide compounds and uses thereof 阿科玛股份有限公司 2020-07-07 CN disclosed