⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6846129 | 0.94 | — | — | |
| SCHEMBL13573374 | 0.91 | HIF1A (0.53) | — | |
| SCHEMBL13546248 | 0.91 | — | — | |
| Water SCHEMBL8152740 | 0.91 | — | — | |
| SCHEMBL7521978 | 0.88 | — | — | |
| SCHEMBL7940025 | 0.86 | HIF1A (0.47) | — | |
| SCHEMBL317349 | 0.84 | — | — | |
| SCHEMBL139711 | 0.77 | — | — | |
| SCHEMBL16816939 | 0.77 | HIF1A (0.82) | — | |
| SCHEMBL30678319 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-61032431-A | — | — | None | — | — | JP | disclosed |
| JP-S6132431-A | GLASS FOR PASSIVATION | TOSHIBA CORP | 1986-02-15 | — | — | JP | disclosed |