⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13221841 | 0.67 | — | — | |
| SCHEMBL5933741 | 0.65 | — | — | |
| SCHEMBL327722 | 0.64 | — | — | |
| SCHEMBL23136805 | 0.62 | — | — | |
| SCHEMBL13997643 | 0.61 | — | — | |
| SCHEMBL9412996 | 0.61 | — | — | |
| SCHEMBL13652671 | 0.61 | — | — | |
| SCHEMBL21024527 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL21827259 | 0.61 | — | — | |
| SCHEMBL12904206 | 0.61 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2835431-B1 | HEAT TREATMENT APPARATUS | KANTO YAKIN KOGYO CO LTD (JP) | 2017-12-20 | — | — | EP | disclosed |