⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5833505 | 0.80 | — | — | |
| SCHEMBL3690497 | 0.79 | — | — | |
| SCHEMBL1608598 | 0.79 | TSHR (0.33) | — | |
| SCHEMBL3481789 | 0.76 | DNM1 (0.39) | — | |
| SCHEMBL17784248 | 0.74 | — | — | |
| SCHEMBL27812172 | 0.74 | DNM1 (0.37) | — | |
| Ammonia Solution, Strong SCHEMBL29209597 | 0.74 | — | — | |
| SCHEMBL6298249 | 0.73 | DNM1 (0.41) | — | |
| SCHEMBL2867544 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL2503509 | 0.73 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1672017-A2 | Rubber compositions | Degussa GmbH (DE) | 2006-06-21 | — | — | EP | claimed |
| US-20100105805-A1 | PROCESS FOR PRODUCING RUBBER COMPOSITION FOR TIRE TREAD | BRIDGESTONE CORPORATION (JP) | 2010-04-29 | — | — | US | disclosed |
| EP-2128186-A1 | PROCESS FOR PRODUCING RUBBER COMPOSITION FOR TIRE TREAD | Bridgestone Corporation (JP) | 2009-12-02 | — | — | EP | disclosed |
| US-7384997-B2 | Mixture containing organosilicon compound | EVONIK DEGUSSA GMBH (DE) | 2008-06-10 | — | — | US | disclosed |
| US-20060160935-A1 | Mixture containing organosilicon compound | DEGUSSA AG (DE) | 2006-07-20 | — | — | US | disclosed |
| EP-1672017-A2 | Rubber compositions | Degussa GmbH (DE) | 2006-06-21 | — | — | EP | disclosed |