SCHEMBL9015599

SCHEMBL9015599

CCCCCCSCCC(=O)OOC(C)(C)CCC(C)(C)OOC(=O)CCSCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
CYP2C9 P11712 1/20 0.41
BLM P54132 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CES1 P23141 5/20 0.41
FAAH O00519 4/20 0.41
PLA2G6 O60733 1/20 0.41
PLA2G4B P0C869 1/20 0.40
DGKA P23743 1/20 0.35
LMNA P02545 2/20 0.33
ACHE P22303 2/20 0.33
CA2 P00918 1/20 0.33
EPHX1 P07099 1/20 0.33
PAM P19021 1/20 0.33

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
SCHEMBL9015739 0.94 CES2 (0.37) CES2GMNNTP53POLBMAPT
SCHEMBL9015710 0.91 PLA2G4B (0.35) CES2GMNNTP53POLBMAPT
SCHEMBL4817980 0.84 DGKA (0.50) CES2MAPTHSD17B10CES1DGKA
SCHEMBL10712716 0.84 DGKA (0.50) CES2MAPTHSD17B10CES1DGKA
SCHEMBL19118231 0.84 DGKA (0.50) CES2MAPTHSD17B10CES1DGKA
SCHEMBL19117989 0.84 DGKA (0.50) CES2MAPTHSD17B10CES1DGKA
SCHEMBL9015583 0.84 CES2 (0.40) CES2GMNNTP53POLBMAPT
SCHEMBL9015664 0.82 DGKA (0.47) CES2GMNNTP53POLBMAPT
SCHEMBL1581535 0.82 DGKA (0.47) CES2MAPTCES1FAAHDGKA
SCHEMBL9015614 0.81 DGKA (0.46) CES2GMNNTP53POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516856-A IMPROVED PROCESS FOR THE MODIFICATION OF THE MOLECULAR CHAIN OF A POLYMER ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-05-14 US disclosed
US-5051531-A As polymerization catalysts and for crosslinking ATOCHEM NORTH AMERICA, INC. (US) 1991-09-24 US disclosed