⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL476511 | 0.77 | — | — | |
| Benzene SCHEMBL28109558 | 0.73 | — | — | |
| SCHEMBL4999945 | 0.73 | — | — | |
| SCHEMBL1899256 | 0.71 | PDGFRB (0.30) | — | |
| SCHEMBL2904512 | 0.68 | PSMB5 (0.34) | — | |
| SCHEMBL2904517 | 0.68 | PSMB5 (0.34) | — | |
| SCHEMBL17633828 | 0.68 | PSMB5 (0.34) | — | |
| SCHEMBL8974268 | 0.67 | — | — | |
| SCHEMBL4943184 | 0.66 | — | — | |
| SCHEMBL17633677 | 0.63 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11028256-B2 | Silica-containing rubber compositions containing specified coupling agents and related methods | BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) | 2021-06-08 | — | — | US | disclosed |
| CN-106831845-B | Boron-containing organosilicon compounds, method for the production and use thereof | 北京康美特科技股份有限公司 | 2021-01-26 | — | — | CN | disclosed |
| CN-106854451-B | Sealing agent for solar cell module, and sealing method for solar cell module | 北京康美特科技股份有限公司 | 2020-10-02 | — | — | CN | disclosed |
| US-20200123349-A1 | SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS | BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) | 2020-04-23 | — | — | US | disclosed |
| US-20170247532-A1 | SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS | BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC | 2017-08-31 | — | — | US | disclosed |
| EP-3197950-A1 | SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS | Bridgestone Americas Tire Operations, LLC (US) | 2017-08-02 | — | — | EP | disclosed |
| WO-2016048935-A1 | SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS | BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) | 2016-03-31 | — | — | WO | disclosed |