SCHEMBL888482

SCHEMBL888482

CCOC(=O)C(COCC(C)C)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.48
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
PIN1 Q13526 1/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
PKM P14618 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL820725 0.89 MMP8 (0.51) MMP8GAASMN1; SMN2PIN1KDM4E
SCHEMBL20995910 0.84 MMP8 (0.48) MMP8GAASMN1; SMN2PIN1KDM4E
SCHEMBL819324 0.82 MMP8 (0.51) MMP8GAASMN1; SMN2PIN1KDM4E
SCHEMBL27995630 0.82 MMP8 (0.51) MMP8GAASMN1; SMN2PIN1KDM4E
SCHEMBL819063 0.81 NPSR1 (0.43) GAASMN1; SMN2KDM4ETSHRALDH1A1
SCHEMBL23027214 0.80 GAA (0.62) MMP8GAAPIN1KDM4EALDH1A1
SCHEMBL5972492 0.80 MMP8 (0.56) MMP8GAASMN1; SMN2PIN1KDM4E
SCHEMBL805646 0.80 GAA (0.62) MMP8GAAPIN1KDM4EALDH1A1
SCHEMBL260296 0.80 GAA (0.62) MMP8GAAPIN1KDM4EALDH1A1
SCHEMBL3456532 0.80 MMP8 (0.43) MMP8GAASMN1; SMN2PIN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103289210-A Polypropylene resin composition and molded body containing same SUMITOMO CHEMICAL CO 2013-09-11 CN disclosed
US-20130190464-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-25 US disclosed
CN-103044584-A Method for preparing solid catalyst component for olefin polymerization SUMITOMO CHEMICAL CO 2013-04-17 CN disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed