SCHEMBL5487989

SCHEMBL5487989

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

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.37
HTR2A P28223 1/20 0.35
CYP1A2 P05177 1/20 0.34
ALOX5 P09917 1/20 0.34
MAOA P21397 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2A6 P11509 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL5490217 0.83 IDO1 (0.38) SMN1; SMN2
SCHEMBL5484319 0.81 ADRB2 (0.46) MAPK1CYP2A6
SCHEMBL5494536 0.81 ACHE (0.44) ALOX5ALDH1A1SMN1; SMN2
SCHEMBL5489949 0.79 AOC3 (0.35) MAOAALDH1A1
SCHEMBL5413664 0.78 TAAR1 (0.52) MAOAALDH1A1
SCHEMBL11839524 0.78 ESR1 (0.38) MAPK1
SCHEMBL5491106 0.78 L3MBTL1 (0.48) CYP1A2MAPK1CYP2A6ALDH1A1SMN1; SMN2
SCHEMBL5490777 0.76 GRIA4 (0.46)
SCHEMBL28430376 0.76 PYCR1 (0.40) PYCR1HTR2ACYP1A2ALOX5MAOA
SCHEMBL28344445 0.73 ALDH1A1 (0.44) PYCR1HTR2AALOX5CYP2A6ALDH1A1

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