SCHEMBL819688

SCHEMBL819688

CCOCC(C(=O)OC)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 2/20 0.40
THRB P10828 2/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SLC6A3 Q01959 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
MMP2 P08253 2/20 0.36
CA9 Q16790 2/20 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
SCHEMBL888479 0.98 ALDH1A1 (0.38) ALDH1A1NPSR1TP53TSHRTHRB
SCHEMBL888438 0.88 ALDH1A1 (0.44) ALDH1A1NPSR1TSHRTHRBATM
SCHEMBL819301 0.86 CYP2D6 (0.43) ALDH1A1NPSR1TSHRTHRBATM
SCHEMBL819467 0.84 NPSR1 (0.44) ALDH1A1NPSR1TP53TSHRTHRB
SCHEMBL12401977 0.84 NPSR1 (0.44) ALDH1A1NPSR1TP53TSHRTHRB
SCHEMBL28902148 0.83 CYP2C9 (0.44) ALDH1A1NPSR1TSHRTHRBATM
SCHEMBL13545056 0.82 TP53 (0.44) ALDH1A1NPSR1TP53TSHRTHRB
SCHEMBL820265 0.82 NPSR1 (0.42) ALDH1A1NPSR1TP53TSHRTHRB
SCHEMBL818669 0.81 ALDH1A1 (0.35) ALDH1A1NPSR1TSHRTHRBATM
SCHEMBL28488230 0.81 CYP2C9 (0.42) ALDH1A1NPSR1TSHRTHRBATM

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