SCHEMBL817781

SCHEMBL817781

CCOCC(C(=O)OCC)(C1CCCC1)C1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.35
THRB P10828 2/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.32
FKBP1A P62942 2/20 0.32
PKM P14618 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 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
SCHEMBL820065 0.98 ALDH1A1 (0.37) ALDH1A1THRBATML3MBTL1CYP4F2
SCHEMBL3822801 0.86 ALDH1A1 (0.35) ALDH1A1THRBATML3MBTL1CYP4F2
SCHEMBL820135 0.79 ALDH1A1 (0.32) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL27863457 0.78 CHRM2 (0.38) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL901251 0.78 KMT2A (0.39) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL888624 0.78 MMP8 (0.33) ALDH1A1THRBATML3MBTL1CYP4F2
SCHEMBL9931238 0.77 ALDH1A1 (0.39) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL888644 0.76 ALDH1A1 (0.34) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL28867351 0.76 ALDH1A1 (0.40) ALDH1A1THRBATML3MBTL1KMT2A
SCHEMBL888473 0.75 MMP8 (0.40) 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 5 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-8288488-B2 Process for producing solid catalyst component for olefin polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-16 US disclosed
US-20110269929-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed