SCHEMBL7943595

SCHEMBL7943595

CCCC[Si](C)(C)OC1C=Cc2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
HTR2A P28223 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
NFKB1 P19838 1/20 0.32
CHRM3 P20309 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
THPO P40225 1/20 0.32
OPRK1 P41145 1/20 0.32

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
SCHEMBL9495808 0.77 RET (0.35) KDM4EHTR2ALMNATP53CHRM2
SCHEMBL29815940 0.75 EYA2 (0.43) KDM4EHTR2ALMNATP53CHRM2
SCHEMBL4506450 0.75 EYA2 (0.43) KDM4EHTR2ALMNATP53CHRM2
SCHEMBL5031539 0.74 EYA2 (0.48) KDM4EHTR2ALMNATP53CHRM2
SCHEMBL5031504 0.73 EYA2 (0.50) HTR2ALMNATP53CHRM2CYP3A4
SCHEMBL31740759 0.73 EYA2 (0.50) HTR2ALMNATP53CHRM2CYP3A4
SCHEMBL27819841 0.73 EYA2 (0.50) HTR2ALMNATP53CHRM2CYP3A4
SCHEMBL459514 0.72 RET (0.32) HTR2ARETHTR6
SCHEMBL29434193 0.71 RET (0.44) KDM4EHTR2ALMNATP53CHRM2
SCHEMBL4516491 0.71 RET (0.42) KDM4EHTR2ALMNATP53CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137677-A2 CATALYST AND PROCESS FOR OLEFIN POLYMERIZATION BOREALIS A/S (DK) 2001-10-04 EP disclosed
WO-2000034341-A2 CATALYST AND PROCESS FOR OLEFIN POLYMERIZATION BOREALIS A/S (DK) 2000-06-15 WO disclosed