SCHEMBL9015619

SCHEMBL9015619

CC(CC(C)(C)OOC(C)(C)C)OC(=O)OCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.38
GAA P10253 7/20 0.37
ALDH1A1 P00352 5/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 4/20 0.35
TSHR P16473 3/20 0.35
MEN1 O00255 3/20 0.35
MAPK1 P28482 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
BLM P54132 2/20 0.35
ATM Q13315 2/20 0.35
HIF1A Q16665 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MAPT P10636 2/20 0.35
USP2 O75604 1/20 0.35
CYP2D6 P10635 1/20 0.35
LMNA P02545 3/20 0.35
GSR P00390 2/20 0.35
GMNN O75496 1/20 0.34

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
SCHEMBL9015692 0.85 GAA (0.41) HMGCRGAAALDH1A1KMT2ATSHR
SCHEMBL9015645 0.81 GAA (0.42) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015622 0.81 HMGCR (0.38) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015698 0.81 GAA (0.46) HMGCRGAAALDH1A1KMT2ATSHR
SCHEMBL9015644 0.80 LMNA (0.40) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015732 0.78 GAA (0.49) HMGCRGAAALDH1A1KMT2AMEN1
SCHEMBL9015729 0.77 GAA (0.49) HMGCRGAAALDH1A1KMT2ATSHR
SCHEMBL9015696 0.76 LMNA (0.43) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL11608305 0.74
SCHEMBL9015713 0.74 GAA (0.56) HMGCRGAAALDH1A1KMT2AMEN1

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 5 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 claimed
EP-0344733-A2 Novel antioxidant-peroxides and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-12-06 EP claimed
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
EP-0344733-A2 Novel antioxidant-peroxides and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-12-06 EP disclosed