SCHEMBL9015622

SCHEMBL9015622

CC(CC(C)(C)C(C)(C)C(O)O)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 2/20 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
GMNN O75496 1/20 0.34
GABBR2 O75899 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
SCHEMBL9015619 0.81 HMGCR (0.38) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015702 0.81 GAA (0.46) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015646 0.80 LMNA (0.40) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL28850429 0.73 HMGCR (0.49) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL9015645 0.73 GAA (0.42) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL11761704 0.71 HMGCR (0.47) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL6403664 0.70 ALDH1A1 (0.49) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL931514 0.70 ALDH1A1 (0.51) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL6403668 0.70 GAA (0.53) HMGCRGAAALDH1A1TDP1KMT2A
SCHEMBL18670907 0.70 HMGCR (0.46) HMGCRGAAALDH1A1TDP1KMT2A

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 claimed
US-5051531-A As polymerization catalysts and for crosslinking ATOCHEM NORTH AMERICA, INC. (US) 1991-09-24 US disclosed