SCHEMBL27455331

SCHEMBL27455331

CC(C)c1cc(CC[Si](C)(C)c2cccs2)cc(C(C)C)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.45
GABRB1 P18505 6/20 0.45
GABRB2 P47870 3/20 0.45
GABRA5 P31644 2/20 0.45
GABRA3 P34903 2/20 0.45
GABRA2 P47869 2/20 0.45
GABRA4 P48169 2/20 0.45
GABRA6 Q16445 2/20 0.45
PTGS1 P23219 2/20 0.40
PTGS2 P35354 1/20 0.40
GSR P00390 1/20 0.39
TRPA1 O75762 1/20 0.38
MAPT P10636 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
FAAH O00519 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 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
SCHEMBL27454667 0.80 PTGS1 (0.41) GABRA1GABRB2PTGS1PTGS2MAPT
SCHEMBL5692015 0.77 GABRA1 (0.49) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL9193416 0.74 GABRA1 (0.54) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL5692077 0.74 GABRA1 (0.54) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL27455835 0.74 GABRA1 (0.46) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL9195415 0.68 GABRA1 (0.51) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL27471347 0.68 PTGS1 (0.30) PTGS1PTGS2
SCHEMBL27456868 0.68 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL13057520 0.65 GSR (0.57) GABRA1GABRB1GABRB2GABRA5GABRA3
SCHEMBL9195024 0.65 GABRA1 (0.51) GABRA1GABRB1GABRB2GABRA5GABRA3

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
CN-1147495-C Alkyl-4-silyl heterocyclic phenols and thiophenols as antioxidants ���µ�˹ҩ�﹫˾ 2004-04-28 CN disclosed
CN-1261367-A Alkyl-4-silylheterocyclic phenols and thiophenols as antioxidant agents HOECHST MARION ROUSSEL INC (US) 2000-07-26 CN disclosed