⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12723987 | 0.94 | — | — | |
| SCHEMBL15958873 | 0.94 | — | — | |
| SCHEMBL17761661 | 0.94 | — | — | |
| SCHEMBL4608955 | 0.94 | — | — | |
| SCHEMBL5374330 | 0.94 | — | — | |
| SCHEMBL3295943 | 0.94 | — | — | |
| SCHEMBL9419750 | 0.89 | — | — | |
| SCHEMBL4868112 | 0.89 | — | — | |
| SCHEMBL4865350 | 0.89 | — | — | |
| SCHEMBL4864365 | 0.89 | — | — |
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-7087549-B2 | Calcium-based catalyst system | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2006-08-08 | — | — | US | claimed |
| US-20050181935-A1 | Calcium-based catalyst system | THE GOODYEAR TIRE & RUBBER COMPANY | 2005-08-18 | — | — | US | claimed |