SCHEMBL7519174

SCHEMBL7519174

CCCc1cc(CC[Si](C)(C)C)c(CCC)cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.47
ESR1 P03372 3/20 0.42
ESR2 Q92731 3/20 0.42
ALOX5 P09917 2/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
TDP1 Q9NUW8 5/20 0.36
RECQL P46063 3/20 0.36
THRB P10828 3/20 0.36
APEX1 P27695 2/20 0.36
RAD52 P43351 2/20 0.36
GAPDH P04406 1/20 0.36
BLM P54132 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN11 Q06124 1/20 0.36
MAPT P10636 5/20 0.36
LMNA P02545 1/20 0.36
XBP1 P17861 1/20 0.36
HIF1A Q16665 1/20 0.36
KDM4E B2RXH2 4/20 0.35

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
SCHEMBL7523141 0.89 TYR (0.49) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL1760537 0.81 HMGCR (0.64) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL11024762 0.79 HMGCR (0.61) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL7526680 0.79 ESR1 (0.39) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL11840310 0.77 HMGCR (0.59) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL7522400 0.77 GABRA1 (0.43) MEN1KMT2ATDP1RECQLTHRB
SCHEMBL5678813 0.76 HMGCR (0.52) HMGCRALOX5MEN1KMT2ATDP1
SCHEMBL9861549 0.74 HMGCR (0.47) HMGCRESR1ESR2ALOX5MEN1
SCHEMBL5692145 0.73 DHFR (0.42) HMGCRESR1ESR2ALOX5PTPN1
SCHEMBL6420539 0.73 HMGCR (0.47) HMGCRESR1ESR2ALOX5MEN1

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