SCHEMBL888266

SCHEMBL888266

CCOCC(CC(C)C)(C(=O)OCC)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.39
METAP2 P50579 1/20 0.33
ALDH1A1 P00352 6/20 0.33
THRB P10828 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.30
GAA P10253 2/20 0.30
ALOX15 P16050 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL888473 0.99 MMP8 (0.40) MMP8METAP2ALDH1A1THRBATM
SCHEMBL888462 0.89 MMP8 (0.39) MMP8METAP2ALDH1A1THRBATM
SCHEMBL888315 0.87 MMP8 (0.40) MMP8METAP2ALDH1A1THRBATM
SCHEMBL820061 0.84
SCHEMBL819616 0.83
SCHEMBL4414462 0.78 MMP8 (0.44) MMP8METAP2ALDH1A1THRBATM
SCHEMBL888644 0.77 ALDH1A1 (0.34) MMP8METAP2ALDH1A1THRBATM
SCHEMBL888551 0.77 NPSR1 (0.36) MMP8NPSR1TSHRSMN1; SMN2
SCHEMBL7785262 0.76 MMP8 (0.45) MMP8METAP2ALDH1A1THRBATM
SCHEMBL820065 0.76 ALDH1A1 (0.37) ALDH1A1THRBATML3MBTL1CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130190464-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-25 US disclosed
US-20130109789-A1 OLEFIN POLYMERIZATION CATALYST, PROCESS FOR PRODUCING OLEFIN POLYMER, POLYPROPYLENE RESIN COMPOSITION AND ARTICLE COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-02 US disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed