SCHEMBL6676515

SCHEMBL6676515

Cc1cccc([SiH2]CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 2/20 0.43
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
GAA P10253 6/20 0.39
ALDH1A1 P00352 5/20 0.39
TSHR P16473 3/20 0.39
LMNA P02545 2/20 0.39
CA2 P00918 3/20 0.39
MAPK1 P28482 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
BLM P54132 2/20 0.38
ATM Q13315 2/20 0.38

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
SCHEMBL7524517 0.87 ALDH1A1 (0.37) SCN2AGABRA1GABRB2GAAALDH1A1
SCHEMBL5692376 0.84 PTGS1 (0.42) GAAALDH1A1CA2MAPK1KDM4E
SCHEMBL5692161 0.82 CA2 (0.43) SCN2AGABRA1GABRB2GAAALDH1A1
SCHEMBL9007326 0.80 SCN2A (0.31) SCN2A
SCHEMBL7521592 0.79 ALOX15 (0.39) SCN2AGABRA1GABRB2GAAALDH1A1
SCHEMBL5692101 0.78 ALOX5 (0.34) GABRA1GABRB2ALDH1A1ATM
SCHEMBL5692018 0.78 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRLMNA
SCHEMBL7523209 0.77 GABRA1 (0.41) SCN2AGABRA1GABRB2GAAALDH1A1
SCHEMBL7519263 0.77 SCN2A (0.43) SCN2AGABRA1GABRB2GAAALDH1A1
SCHEMBL7527865 0.77 TRPA1 (0.35) GABRA1GABRB2ALDH1A1TSHRMAPK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1468692-A2 Use of 2,6-di-alkyl-4-silyl-phenols for treating xanthoma MERRELL PHARMACEUTICALS INC. (US) 2004-10-20 EP disclosed
US-5532400-A 2,6-di-alkyl-4-silyl-phenols as antiatheroscelerotic agents MERRELL PHARMACEUTICALS INC. (US) 1996-07-02 US disclosed
EP-0464852-B1 Novel 2,6-di-alkyl-4-silyl-phenols as antiatherosclerotic agents and as antioxidants MERRELL DOW PHARMA (US) 1996-03-20 EP disclosed
US-5155250-A 2,6-DI-ALKYL-4-SILYL-PHENOLS AS ANTIATHEROSCEROTIC AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-10-13 US disclosed
EP-0464852-A1 Novel 2,6-di-alkyl-4-silyl-phenols as antiatherosclerotic agents and as antioxidants MERRELL PHARMACEUTICALS INC. (US) 1992-01-08 EP disclosed