SCHEMBL5481495

SCHEMBL5481495

COc1ccc([Si](Cl)(Cl)Cl)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
TUBB1 Q9H4B7 2/20 0.42
MAPT P10636 4/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
NQO2 P16083 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38

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
SCHEMBL5487414 0.78 MAPT (0.44) ALDH1A1MAPTHPGDCYP2C19POLB
SCHEMBL904258 0.73 ALDH1A1 (0.48) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL5490961 0.72 ALDH1A1 (0.37) ALDH1A1HPGDSMN1; SMN2L3MBTL1NPC1
SCHEMBL29958505 0.72 ALDH1A1 (0.52) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL929274 0.72 ALDH1A1 (0.52) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL5483458 0.72 CA2 (0.46) TUBB1MAPTHPGDMEN1KMT2A
SCHEMBL258418 0.72 CA12 (0.65) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL811943 0.72 MAPK1 (0.65) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL12326165 0.72 MAPT (0.56) ALDH1A1TUBB1MAPTHPGDCYP1A2
SCHEMBL29697819 0.72 MAPK1 (0.65) ALDH1A1TUBB1MAPTHPGDCYP1A2

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