⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4919150 | 0.80 | — | — | |
| SCHEMBL4921874 | 0.70 | — | — | |
| SCHEMBL497923 | 0.70 | — | — | |
| SCHEMBL4921831 | 0.68 | — | — | |
| SCHEMBL4819725 | 0.67 | — | — | |
| SCHEMBL2419662 | 0.65 | — | — | |
| SCHEMBL18989126 | 0.61 | — | — | |
| SCHEMBL11000347 | 0.61 | — | — | |
| SCHEMBL4910980 | 0.60 | — | — | |
| Oxirane SCHEMBL114760 | 0.59 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7368587-B2 | Functionalized siloxy compound, silica reinforced rubber compositions thereof and tire with component comprised thereof | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2008-05-06 | — | — | US | disclosed |
| US-20060247337-A1 | Functionalized siloxy compound, silica reinforced rubber compositions thereof and tire with component comprised thereof | GOODYEAR TIRE & RUBBER COMPANY, THE | 2006-11-02 | — | — | US | disclosed |