SCHEMBL819199

SCHEMBL819199

CCOC(=O)C(COC)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
TSHR P16473 3/20 0.43
CYP2D6 P10635 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
KDM4E B2RXH2 1/20 0.39
EPHX2 P34913 1/20 0.36

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
SCHEMBL888576 0.98 CYP2D6 (0.43) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
SCHEMBL18706844 0.87 ALDH1A1 (0.43) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
SCHEMBL888438 0.86 ALDH1A1 (0.44) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
SCHEMBL12401977 0.86 NPSR1 (0.44) ALDH1A1NPSR1TSHRTHRBEPHX2
SCHEMBL819467 0.86 NPSR1 (0.44) ALDH1A1NPSR1TSHRTHRBEPHX2
SCHEMBL819301 0.84 CYP2D6 (0.43) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
SCHEMBL820265 0.84 NPSR1 (0.42) ALDH1A1NPSR1TSHRTHRBEPHX2
SCHEMBL4087213 0.84 ALDH1A1 (0.48) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
SCHEMBL934442 0.82 ALDH1A1 (0.47) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1
Hydrochloric Acid SCHEMBL27351255 0.82 ALDH1A1 (0.47) ALDH1A1NPSR1TSHRCYP2D6L3MBTL1

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