SCHEMBL7933773

SCHEMBL7933773

CC(C)OC(=O)CCC(C)C(=O)OC(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
TSHR P16473 2/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 3/20 0.37
CYP2D6 P10635 1/20 0.36
NOTUM Q6P988 1/20 0.36
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
HTT P42858 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EPHX2 P34913 1/20 0.32
AGTR1 P30556 1/20 0.32

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
SCHEMBL494326 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL494700 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL495523 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL495236 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL493903 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL494873 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL494687 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL495710 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL495093 0.84 LMNA (0.61) LMNAMAPTALDH1A1GAASMN1; SMN2
SCHEMBL22355214 0.83 LMNA (0.34) LMNATSHRCYP1A2CYP2D6GAA

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
EP-2733780-B1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY USING SAME LG CHEMICAL LTD (KR) 2017-08-30 EP disclosed
CN-103635494-B Alpha-olefin polymerization method 胜亚诺盟股份有限公司 2016-12-14 CN disclosed
US-6235854-B1 PREPARED BY CONTACTING MAGNESIUM CHLORIDE OR MAGNESIUM DIETHOXIDE WITH TICL4 AND HAVING A DIALKYL PHTHALATE SUPPORTED THEREON MITSUI CHEMICALS, INC. (JP) 2001-05-22 US disclosed
EP-0796872-A1 SOLID TITANIUM CATALYST COMPONENT AND UTILIZATION THEREOF IN OLEFIN POLYMERIZATION CATALYST MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-09-24 EP disclosed
EP-0086643-A2 Catalyst composition and process for polymerizing olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1983-08-24 EP disclosed