SCHEMBL7522339

SCHEMBL7522339

CCc1cccc([SiH2]CSc2cc(C)c(O)c(C)c2C)c1CC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 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
SCHEMBL7526697 0.86
SCHEMBL7517211 0.85 ALOX5 (0.33)
SCHEMBL7526911 0.82 GABRA1 (0.39) GABRA1GABRB2
SCHEMBL7525678 0.79 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL8442028 0.78 GABRA1 (0.36) GABRA1GABRB2KMT2A
SCHEMBL7520240 0.76 GABRA1 (0.38) GABRA1GABRB2MEN1NPC1KMT2A
SCHEMBL7520622 0.75 FAAH (0.34) GABRA1GABRB2MEN1NPC1KMT2A
SCHEMBL7521936 0.74 ALDH1A1 (0.35) GABRA1GABRB2
SCHEMBL7517853 0.70 SHBG (0.36) GABRA1GABRB2
SCHEMBL7521149 0.69 HSP90AA1 (0.34) GABRA1GABRB2

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