SCHEMBL7516554

SCHEMBL7516554

CNc1ccc([Si](C)(C)CCc2cc(C(C)(C)C)c(OC(C)=O)c(C(C)(C)C)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.34
KMT2A Q03164 2/20 0.32
TOP1 P11387 1/20 0.32
NR1H4 Q96RI1 2/20 0.32
MEN1 O00255 1/20 0.31
VCAM1 P19320 2/20 0.31
LMNA P02545 2/20 0.30
MAPT P10636 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7523700 0.86 NR1H4 (0.35) GAAKMT2ANR1H4MEN1VCAM1
SCHEMBL7522609 0.84 CALM1 (0.33) GAAKMT2ANR1H4MEN1VCAM1
SCHEMBL7520303 0.83 VCAM1 (0.33) GAATOP1NR1H4VCAM1MAPT
SCHEMBL7525623 0.82 GAA (0.42) GAAKMT2AMEN1LMNAMAPT
SCHEMBL7522270 0.74 GAA (0.37) GAAKMT2AMEN1VCAM1
SCHEMBL7527917 0.73 VCAM1 (0.40) GAAKMT2AMEN1VCAM1
SCHEMBL9354087 0.72 VCAM1 (0.45) GAAKMT2AVCAM1
SCHEMBL7521009 0.72 VCAM1 (0.37) GAAKMT2AVCAM1
SCHEMBL7517609 0.71 VCAM1 (0.45) GAAVCAM1MAPTSMN1; SMN2
SCHEMBL7520539 0.70 ALOX15 (0.39) GAANR1H4LMNAMAPTSMN1; SMN2

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