SCHEMBL5082891

SCHEMBL5082891

CCOC(=O)C(CC(C)C)C(C)OC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
GAA P10253 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.44
TSHR P16473 3/20 0.44
TP53 P04637 1/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.42
GLA P06280 1/20 0.42
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ESR1 P03372 1/20 0.41

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
SCHEMBL5079860 0.89 TSHR (0.47) NPC1SMN1; SMN2RAB9ALMNATSHR
SCHEMBL5082829 0.88 NPC1 (0.49) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5082833 0.87 PDCD1 (0.50) NPC1SMN1; SMN2GAARAB9ALMNA
SCHEMBL5082847 0.87 TSHR (0.47) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5079895 0.86 KMT2A (0.44) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5082861 0.86 LMNA (0.47) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5941374 0.85 TSHR (0.51) NPC1SMN1; SMN2RAB9ALMNATSHR
SCHEMBL5082842 0.84 MMP8 (0.48) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5083331 0.84 LMNA (0.43) MEN1KMT2ANPC1SMN1; SMN2GAA
SCHEMBL5082120 0.83 LMNA (0.45) MEN1KMT2ANPC1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1746110-B1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2015-03-11 EP disclosed
US-7351778-B2 Catalyst component for olefin polymerization and catalyst comprising the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-04-01 US disclosed
EP-1746110-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF China Petroleum & Chemical Corporation (CN) 2007-01-24 EP disclosed
US-20060287446-A1 Catalyst component for olefin polymerization and catalyst comprising the same BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CHINA PETROLEUM & CHEMICAL COPORATION (CN) 2006-12-21 US disclosed