SCHEMBL8845386

SCHEMBL8845386

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCCC(OC(=O)CCCCCCC/C=C\CCCCCC)C(COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.67
PRKCE Q02156 2/20 0.67
PRKCQ Q04759 2/20 0.67
PRKCD Q05655 2/20 0.67
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
SELP P16109 1/20 0.61
FAAH O00519 3/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57
CNR1 P21554 1/20 0.57
CNR2 P34972 1/20 0.57
NR5A2 O00482 1/20 0.57
NR5A1 Q13285 1/20 0.57
S1PR1 P21453 1/20 0.55

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
SCHEMBL1830979 0.96 PRKCA (0.71) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL1835410 0.96 PRKCA (0.71) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL18381279 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL16015656 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL3117216 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL24075747 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL12464578 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL22077701 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL22078371 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1
SCHEMBL16023628 0.91 PRKCA (0.80) PRKCAPRKCEPRKCQPRKCDALDH1A1

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
US-5591615-A Mutant of Geotrichum candidum which produces novel enzyme system to selectively hydrolyze triglycerides HENKEL CORPORATION (US) 1997-01-07 US disclosed