SCHEMBL9015688

SCHEMBL9015688

CC(CC(C)(C)OC(=O)c1c2c(C(C)(C)C)c(O)c(C(C)(C)C)c1OO2)OC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
RECQL P46063 1/20 0.34
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
SERPINE1 P05121 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALOX5 P09917 2/20 0.31
PTGS1 P23219 2/20 0.31
PTGS2 P35354 2/20 0.31
TNFRSF1A P19438 1/20 0.31
HMGCR P04035 1/20 0.31
GLRA3 O75311 1/20 0.30
GLRB P48167 1/20 0.30

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
SCHEMBL9015696 0.79 LMNA (0.43) LMNARECQLCA12CA1CA2
SCHEMBL9015644 0.76 LMNA (0.40) LMNARECQLCA12CA1CA2
SCHEMBL9015694 0.74 LMNA (0.39) LMNARECQLCA12CA1CA2
SCHEMBL9015742 0.72
SCHEMBL9015840 0.72 LMNA (0.46) LMNARECQLCA12CA1CA2
SCHEMBL29160406 0.72 CA2 (0.59) LMNARECQLCA12CA1CA2
SCHEMBL9015646 0.71 LMNA (0.40) LMNARECQLCA12CA1CA2
SCHEMBL25639251 0.70 KMT2A (0.48) LMNARECQLCA12CA1CA2
SCHEMBL9015594 0.67 LMNA (0.41) LMNARECQLCA12CA1CA2
SCHEMBL11612164 0.67 LMNA (0.53) LMNARECQLCA1CA2MEN1

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