SCHEMBL888463

SCHEMBL888463

CCOC(=O)C(C1CCCC1)C(CC(C)C)OCC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 3/20 0.37
MMP1 P03956 2/20 0.36
MMP8 P22894 1/20 0.36
ADAM17 P78536 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
METAP2 P50579 1/20 0.34
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.34
CASP6 P55212 1/20 0.33
MMP9 P14780 1/20 0.33
MMP14 P50281 1/20 0.33

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
SCHEMBL888424 0.98 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAALOX15NPSR1
SCHEMBL888353 0.86 MMP1 (0.34) ALDH1A1SMN1; SMN2GAAALOX15NPSR1
SCHEMBL888466 0.85 MMP1 (0.34) ALDH1A1SMN1; SMN2GAAALOX15NPSR1
SCHEMBL13269664 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAALOX15NPSR1
SCHEMBL13269026 0.80 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2GAAALOX15NPSR1
SCHEMBL893144 0.80 ALDH1A1 (0.51) ALDH1A1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL660922 0.78 ALDH1A1 (0.54) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL1785494 0.78 ALDH1A1 (0.54) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL23197887 0.78 ALDH1A1 (0.44) ALDH1A1NPSR1TSHRL3MBTL1METAP2
SCHEMBL888367 0.78 ALDH1A1 (0.44) ALDH1A1NPSR1TSHRL3MBTL1THRB

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