SCHEMBL7524487

SCHEMBL7524487

CC(C)(C)c1cc(SC[Si](C)(C)c2ccc(N)cc2)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 4/20 0.40
ALDH1A1 P00352 6/20 0.38
ALOX15 P16050 3/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
TYR P14679 1/20 0.38
HTT P42858 1/20 0.38
NFE2L2 Q16236 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 3/20 0.33
GAA P10253 3/20 0.33
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSP90AA1 P07900 2/20 0.33
HSP90AB1 P08238 2/20 0.33
KDM4E B2RXH2 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
SCHEMBL7521719 0.86 ALOX15 (0.42) ALDH1A1ALOX15LMNACYP2C9TYR
SCHEMBL7525362 0.86 ALDH1A1 (0.40) NR1H4ALDH1A1ALOX15NR1I2LMNA
SCHEMBL7522289 0.85 NR1H4 (0.40) NR1H4ALDH1A1ALOX15NR1I2LMNA
SCHEMBL7523469 0.82 ALOX15 (0.40) NR1H4ALDH1A1ALOX15NR1I2LMNA
SCHEMBL7520189 0.77 VCAM1 (0.37) NR1H4
SCHEMBL7523538 0.76 ALDH1A1 (0.46) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL7523766 0.75 ALDH1A1 (0.44) NR1H4ALDH1A1ALOX15NR1I2LMNA
SCHEMBL7520674 0.74 NR1H4 (0.52) NR1H4ALDH1A1ALOX15NR1I2LMNA
SCHEMBL7525898 0.73 ALDH1A1 (0.43) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL9788696 0.73 ALDH1A1 (0.53) NR1H4ALDH1A1ALOX15NR1I2LMNA

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 3 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
CN-1216993-A alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents HOECHST MARION ROUSSEL INC (US) 1999-05-19 CN disclosed
US-5608095-A Alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents HOECHST MARION ROUSSEL, INC. (US) 1997-03-04 US disclosed