SCHEMBL8734160

SCHEMBL8734160

CC1CC(=O)c2cccc([Si](C)(C)c3cccc4c3C(C)CC4=O)c21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.38
MAOB P27338 4/20 0.33
CYP19A1 P11511 2/20 0.33
S100A4 P26447 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
AR P10275 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CSNK2A2 P19784 1/20 0.32
CSNK2A1 P68400 1/20 0.32
TOP2A P11388 1/20 0.31
PBRM1 Q86U86 1/20 0.31
TSHR P16473 1/20 0.31
AXL P30530 1/20 0.31
STAT3 P40763 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL2480306 0.77 ACHE (0.41) ACHES100A4CSNK2A2CSNK2A1PBRM1
SCHEMBL8845677 0.72 ACHE (0.62) ACHEMAOBCYP19A1CSNK2A2CSNK2A1
SCHEMBL8903475 0.71 ACHE (0.40) ACHES100A4TSHR
SCHEMBL8904346 0.69 PARP1 (0.36) ACHES100A4CSNK2A2CSNK2A1STAT3
Hydrochloric Acid SCHEMBL8903529 0.68 PARP1 (0.35) ACHES100A4STAT3
SCHEMBL20368206 0.66 ACHE (0.48) ACHEMAOBCYP19A1S100A4KDM4E
SCHEMBL9372008 0.66 ACHE (0.48) ACHEMAOBCYP19A1S100A4KDM4E
SCHEMBL9367273 0.66 ACHE (0.48) ACHEMAOBCYP19A1S100A4KDM4E
SCHEMBL31326549 0.66 ACHE (0.48) ACHEMAOBCYP19A1S100A4KDM4E
SCHEMBL181579 0.66 ACHE (0.48) ACHEMAOBCYP19A1S100A4KDM4E

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
EP-0728773-B1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEM CORP (JP) 1998-11-04 EP disclosed
EP-0693502-B1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEM CORP (JP) 1997-11-05 EP disclosed
US-5594081-A METALLOCENES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-01-14 US disclosed
EP-0728773-A1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-28 EP disclosed
EP-0693502-A1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEMICAL CORPORATION (JP) 1996-01-24 EP disclosed