SCHEMBL6692807

SCHEMBL6692807

CO[Si](CC1CCCCCC1)(OC)OC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
ALDH1A1 P00352 1/20 0.32
ACHE P22303 1/20 0.31
CHRM5 P08912 2/20 0.31
ADRA2C P18825 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
SIGMAR1 Q99720 2/20 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
SCHEMBL721766 1.00 CYP1A2 (0.36) CYP1A2ALDH1A1ACHECHRM5ADRA2C
SCHEMBL6691821 0.97 CYP1A2 (0.32) CYP1A2
SCHEMBL6692444 0.92
SCHEMBL27995317 0.89 CYP1A2 (0.30) CYP1A2
SCHEMBL6691843 0.87
SCHEMBL825364 0.83 CYP1A2 (0.34) CYP1A2ALDH1A1ACHECHRM5ADRA2C
SCHEMBL6697762 0.83 CYP1A2 (0.34) CYP1A2ALDH1A1ACHECHRM5ADRA2C
SCHEMBL28494132 0.82 CYP1A2 (0.36) CYP1A2ALDH1A1SIGMAR1
SCHEMBL7643953 0.80 CYP1A2 (0.36) CYP1A2ALDH1A1ACHECHRM5ADRA2C
SCHEMBL30189746 0.80 CYP1A2 (0.36) CYP1A2ALDH1A1ACHECHRM5ADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004523599-A 2004-08-05 JP claimed
EP-1353961-A2 (CYCLOALKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2003-10-22 EP claimed
US-6469112-B2 SOLID TITANIUM CATALYST COMPONENT; AN ORGANOALUMINUM COMPOUND; AND AN ORGANOSILICON COMPOUND COMPRISING AT LEAST ONE (CYCLOALKYL)METHYL GROUP; MAKING HIGH XYLENE SOLUBLE POLYOLEFINS WITH CATALYTIC EFFICIENCY ENGELHARD CORPORATION 2002-10-22 US claimed
US-20020028893-A1 (Cycloalkyl) methyl silanes as external donors for polyolefin catalysts W. R. GRACE & CO.-CONN. 2002-03-07 US claimed
WO-2002016444-A2 (CYCLOAKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2002-02-28 WO claimed
EP-1353961-A2 (CYCLOALKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2003-10-22 EP disclosed
US-6469112-B2 SOLID TITANIUM CATALYST COMPONENT; AN ORGANOALUMINUM COMPOUND; AND AN ORGANOSILICON COMPOUND COMPRISING AT LEAST ONE (CYCLOALKYL)METHYL GROUP; MAKING HIGH XYLENE SOLUBLE POLYOLEFINS WITH CATALYTIC EFFICIENCY ENGELHARD CORPORATION 2002-10-22 US disclosed
US-20020028893-A1 (Cycloalkyl) methyl silanes as external donors for polyolefin catalysts W. R. GRACE & CO.-CONN. 2002-03-07 US disclosed
WO-2002016444-A2 (CYCLOAKYL)METHYL SILANES AS EXTERNAL DONORS FOR POLYOLEFIN CATALYSTS ENGELHARD CORPORATION (US) 2002-02-28 WO disclosed