⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL465233 | 0.99 | — | — | |
| SCHEMBL465257 | 0.99 | — | — | |
| SCHEMBL2006782 | 0.99 | — | — | |
| SCHEMBL465222 | 0.99 | — | — | |
| SCHEMBL465250 | 0.99 | — | — | |
| SCHEMBL465223 | 0.98 | — | — | |
| SCHEMBL672408 | 0.97 | — | — | |
| SCHEMBL465234 | 0.96 | — | — | |
| SCHEMBL465256 | 0.96 | — | — | |
| SCHEMBL465215 | 0.96 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7960460-B2 | bis-(3-triethoxysilylpropyl) disulfide, bis-(3-triethoxysilylpropyl)tetrasulfide and 1,2,4-tris(6-triethoxysilyl-3,4-dithiaheptyl)cyclohexanel; vulcanizable rubber such as natural rubbers, synthetic polyisoprene, polybutadiene, random styrene-butadiene copolymer; silica as reactive filler | MOMENTIVE PERFORMANCE MATERIALS, INC. (US) | 2011-06-14 | — | — | US | claimed |
| US-7960460-B2 | bis-(3-triethoxysilylpropyl) disulfide, bis-(3-triethoxysilylpropyl)tetrasulfide and 1,2,4-tris(6-triethoxysilyl-3,4-dithiaheptyl)cyclohexanel; vulcanizable rubber such as natural rubbers, synthetic polyisoprene, polybutadiene, random styrene-butadiene copolymer; silica as reactive filler | MOMENTIVE PERFORMANCE MATERIALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |
| US-20080161461-A1 | Free-flowing filler composition and rubber composition containing same | MOMENTIVE PERFORMANCE MATERIALS INC. | 2008-07-03 | — | — | US | disclosed |