SCHEMBL888442

SCHEMBL888442

CCOCC(CC(C)C(C)(C)C)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
TSHR P16473 1/20 0.35
BIRC2 Q13490 5/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
MMP8 P22894 1/20 0.32
MME P08473 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31
ABCB1 P08183 1/20 0.31
CA12 O43570 1/20 0.30
CA14 Q9ULX7 1/20 0.30
MAPT P10636 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL888352 0.88 CPB2 (0.38) CA1CA2L3MBTL1MMP8HSD17B10
SCHEMBL888423 0.84 CA1 (0.43) CA1CA2BIRC2SMN1; SMN2MME
SCHEMBL888390 0.83 CA1 (0.38) CA1CA2TSHRBIRC2SMN1; SMN2
SCHEMBL819562 0.82 MME (0.44) CA1CA2TSHRBIRC2SMN1; SMN2
SCHEMBL819281 0.81 L3MBTL1 (0.30) L3MBTL1
SCHEMBL888626 0.78 CPB2 (0.38) CA1CA2TSHRL3MBTL1MMP8
SCHEMBL888269 0.78 CA2 (0.53) CA1CA2TSHRBIRC2L3MBTL1
SCHEMBL2943135 0.76 CA1 (0.53) CA1CA2TSHRBIRC2SMN1; SMN2
SCHEMBL820260 0.73 CA1 (0.37) CA1CA2TSHRSMN1; SMN2MMP8
SCHEMBL819514 0.71 TSHR (0.40) CA1CA2TSHRSMN1; SMN2ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed