⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13707665 | 0.69 | — | — | |
| SCHEMBL14562847 | 0.68 | — | — | |
| SCHEMBL28368956 | 0.65 | — | — | |
| SCHEMBL6677631 | 0.62 | — | — | |
| SCHEMBL122897 | 0.61 | — | — | |
| SCHEMBL6100800 | 0.61 | — | — | |
| SCHEMBL28368959 | 0.61 | — | — | |
| SCHEMBL13707653 | 0.61 | FAAH (0.32) | — | |
| SCHEMBL4074052 | 0.59 | — | — | |
| Propane SCHEMBL8411429 | 0.59 | TSHR (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244676-B1 | SULFUR-CONTAINING SILANE AS COUPLING AGENTS | GEN ELECTRIC (US) | 2004-10-13 | — | — | EP | disclosed |
| US-6518335-B2 | Made by chlorine-free process by reacting alkoxysilane acetals such as (3,3-dimethoxypropyl)trimethoxysilane with sulfurating agents such as sulfur, hydrogen sulfide, or thiols; use in silica-filled rubbers | CROMPTON CORPORATION | 2003-02-11 | — | — | US | disclosed |
| CN-1394208-A | Sulfur-containing silane coupling agents | CROMPTON CORP (US) | 2003-01-29 | — | — | CN | disclosed |
| US-20020002220-A1 | SULFUR-CONTAINING SILANE COUPLING AGENTS | MOMENTIVE PERFORMANCE MATERIALS INC. | 2002-01-03 | — | — | US | disclosed |