SCHEMBL7525650

SCHEMBL7525650

CNc1ccc([Si](C)(C)COc2cc(C(C)(C)C)c(O)cc2C(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
ATP2A2 P16615 1/20 0.39
ATP2A3 Q93084 1/20 0.39
NR1H4 Q96RI1 1/20 0.36
NR1I2 O75469 1/20 0.31
CYP2C9 P11712 1/20 0.31
MIF P14174 1/20 0.31
TYR P14679 1/20 0.31
HTT P42858 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
Dimethylamine SCHEMBL7520158 0.87 ALOX15 (0.44) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7521656 0.86 ALOX15 (0.45) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7517854 0.85 ALOX15 (0.47) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7521161 0.85 ALDH1A1 (0.42) ALOX15LMNAALDH1A1MAPTNR1H4
SCHEMBL7520154 0.84 ALOX15 (0.43) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7517877 0.82 CA2 (0.41) ALOX15LMNACYP3A4ALDH1A1SMN1; SMN2
SCHEMBL7520539 0.77 ALOX15 (0.39) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7523796 0.76 ALOX15 (0.38) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7516806 0.75 ALOX15 (0.47) ALOX15LMNATP53CYP3A4HPGD
SCHEMBL7527848 0.74 ALOX5 (0.37) GAA

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-0900225-B1 ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS AVENTIS PHARMA INC (US) 2002-01-30 EP disclosed
US-5608095-A Alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents HOECHST MARION ROUSSEL, INC. (US) 1997-03-04 US disclosed