⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL154932 | 0.96 | — | — | |
| SCHEMBL29740320 | 0.96 | — | — | |
| Ammonia Solution, Strong SCHEMBL22960694 | 0.92 | — | — | |
| SCHEMBL22960695 | 0.92 | — | — | |
| SCHEMBL7346525 | 0.77 | — | — | |
| SCHEMBL9065558 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL645626 | 0.73 | — | — | |
| SCHEMBL2633173 | 0.71 | — | — | |
| SCHEMBL13990886 | 0.71 | — | — | |
| SCHEMBL9779838 | 0.71 | — | — |
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-10919818-B1 | Auto-ignition composition | JOYSON SAFETY SYSTEMS ACQUISITION LLC (US) | 2021-02-16 | — | — | US | claimed |
| US-10919818-B1 | Auto-ignition composition | JOYSON SAFETY SYSTEMS ACQUISITION LLC (US) | 2021-02-16 | — | — | US | disclosed |