SCHEMBL6702147

SCHEMBL6702147

CC(=O)O[SiH](OC(C)=O)c1ccccc1C(C)N

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
NFKB1 P19838 1/20 0.33
PNMT P11086 1/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2C P18825 1/20 0.32
HIF1A Q16665 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALOX5 P09917 1/20 0.31
CXCL8 P10145 1/20 0.31
IRAK4 Q9NWZ3 1/20 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
Azetidine SCHEMBL15643264 0.91 SLC6A2 (0.32)
SCHEMBL11762344 0.78 TSHR (0.33) ALDH1A1KDM4E
SCHEMBL6695802 0.77 CYP2D6 (0.38) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL4281366 0.73 ALDH1A1 (0.38) LMNAALDH1A1KDM4E
SCHEMBL6697047 0.72 CYP2D6 (0.35) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL16011951 0.70 GABRA1 (0.38) LMNAALDH1A1
Azetidine SCHEMBL15643228 0.69 CYP1A2 (0.33) CYP1A2CYP3A4CYP2D6NFKB1PNMT
SCHEMBL6564316 0.68 PTGS2 (0.33) ALDH1A1
SCHEMBL2944448 0.68 ALDH1A1 (0.34) CYP1A2CYP3A4CYP2D6LMNAALDH1A1
SCHEMBL10726252 0.67 IRAK4 (0.43) CYP1A2CYP3A4CYP2D6NFKB1PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040197484-A1 Coating liquid for forming insulating film and method for producing insulating film SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-07 US disclosed