SCHEMBL5489949

SCHEMBL5489949

CC(C[Si](Cl)(Cl)Cl)c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.35
HTT P42858 1/20 0.35
IDO1 P14902 2/20 0.34
TDO2 P48775 2/20 0.34
CYP17A1 P05093 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ADRB2 P07550 1/20 0.34
TRPA1 O75762 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL5490217 0.83 IDO1 (0.38) AOC3HTTIDO1ADRB2
SCHEMBL5494536 0.81 ACHE (0.44) AOC3ALDH1A1CA1CA2
SCHEMBL5484319 0.81 ADRB2 (0.46) AOC3IDO1TDO2ADRB2
SCHEMBL5487989 0.79 PYCR1 (0.37) ALDH1A1MAOA
SCHEMBL5413664 0.78 TAAR1 (0.52) AOC3ALDH1A1TRPA1MAOAMAOB
SCHEMBL9079772 0.78 DAO (0.33) AOC3HTT
SCHEMBL11839524 0.78 ESR1 (0.38) AOC3IDO1CA1CA2
SCHEMBL5491106 0.78 L3MBTL1 (0.48) CYP17A1ALDH1A1
SCHEMBL5490777 0.76 GRIA4 (0.46) AOC3CYP17A1
SCHEMBL10281071 0.76 AOC3 (0.38) AOC3HTTIDO1TDO2ALDH1A1

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
US-7291747-B2 Silicon compounds and process for preparation thereof CHISSO CORPORATION (JP) 2007-11-06 US disclosed
US-20040143081-A1 Novel silicon compounds and process for preparation thereof JNC CORPORATION (JP) 2004-07-22 US disclosed