⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL92737 | 0.97 | — | — | |
| SCHEMBL353229 | 0.97 | — | — | |
| SCHEMBL239908 | 0.97 | — | — | |
| SCHEMBL7027341 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL22418822 | 0.95 | NOS2 (0.48) | — | |
| Hydrochloric Acid SCHEMBL1372569 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL1372999 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL22437494 | 0.95 | — | — | |
| SCHEMBL7016182 | 0.95 | — | — | |
| SCHEMBL7016184 | 0.95 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0990670-B1 | Calcium-based catalyst system | GOODYEAR TIRE & RUBBER (US) | 2004-11-03 | — | — | EP | claimed |
| US-20020045720-A1 | Calcium-based catalyst system | THE GOODYEAR TIRE & RUBBER COMPANY | 2002-04-18 | — | — | US | claimed |
| EP-0990670-A1 | Calcium-based catalyst system | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 2000-04-05 | — | — | EP | claimed |