SCHEMBL2853710

SCHEMBL2853710

CCOC(=O)CC(CC(C)(C)CCC(C)C)C(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.36
CPB2 Q96IY4 2/20 0.35
ALDH1A1 P00352 4/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 2/20 0.34
ALOX15 P16050 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
CHRM1 P11229 1/20 0.33
ADORA1 P30542 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TRPA1 O75762 1/20 0.32
TP53 P04637 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
SCHEMBL27968450 0.82 GAA (0.39) MMP8CPB2ALDH1A1TSHRCYP3A4
SCHEMBL28227503 0.82 MMP8 (0.32) MMP8CPB2ALDH1A1TSHRCYP3A4
SCHEMBL1246715 0.80 GAA (0.43) MMP8CPB2ALDH1A1TSHRCYP3A4
SCHEMBL3081469 0.79 CPB2 (0.42) CPB2ALDH1A1TSHRCYP3A4ALOX15
Succinic Acid Diethyl Ester SCHEMBL28226660 0.79 L3MBTL1 (0.33) MMP8KMT2AL3MBTL1POLB
SCHEMBL2457733 0.79 MGAM (0.41) CPB2ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL28226659 0.78 CPB2 (0.33) MMP8CPB2ALDH1A1TSHRCYP3A4
SCHEMBL28284645 0.78 MMP8 (0.31) MMP8ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL29036072 0.78 ALDH1A1 (0.39) MMP8CPB2ALDH1A1TSHRCYP3A4
SCHEMBL29105363 0.76 ALDH1A1 (0.32) ALDH1A1TSHRKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117430735-A Catalyst component for propylene polymerization, preparation method thereof, catalyst and application 中国石油化工股份有限公司 2024-01-23 CN claimed
EP-4186931-A1 POLYPROPYLENE RESIN COMPOSITION WITH HIGH FLOWABILITY AND ARTICLE MOLDED THEREFROM Hanwha TotalEnergies Petrochemical Co., Ltd. (KR) 2023-05-31 EP claimed
EP-4186931-A1 POLYPROPYLENE RESIN COMPOSITION WITH HIGH FLOWABILITY AND ARTICLE MOLDED THEREFROM Hanwha TotalEnergies Petrochemical Co., Ltd. (KR) 2023-05-31 EP disclosed
US-8822366-B2 Solid titanium catalyst component, catalyst for olefin polymerization and process for polymerizing olefin MITSUI CHEMICALS, INC. (JP) 2014-09-02 US disclosed
EP-2206731-B1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND OLEFIN POLYMERIZATION METHOD MITSUI CHEMICALS INC (JP) 2013-08-28 EP disclosed
US-20100227991-A1 SOLID TITANIUM CATALYST COMPONENT, CATALIST FOR OLEFIN POLYMERIZATION AND PROCESS FOR POLYMERIZING OLEFIN MITSUI CHEMICALS, INC. (JP) 2010-09-09 US disclosed
EP-2206731-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND OLEFIN POLYMERIZATION METHOD Mitsui Chemicals, Inc. (JP) 2010-07-14 EP disclosed