⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34707 | 0.87 | — | — | |
| SCHEMBL6131477 | 0.87 | — | — | |
| SCHEMBL1365682 | 0.75 | — | — | |
| SCHEMBL5013648 | 0.75 | — | — | |
| SCHEMBL9569076 | 0.75 | — | — | |
| SCHEMBL23573877 | 0.75 | — | — | |
| SCHEMBL1993904 | 0.75 | — | — | |
| SCHEMBL5014678 | 0.75 | — | — | |
| SCHEMBL20502784 | 0.75 | — | — | |
| SCHEMBL9464215 | 0.75 | — | — |
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-0550203-A1 | Reinforced niobium-titanium-aluminium-hafnium composite alloy | GENERAL ELECTRIC COMPANY (US) | 1993-07-07 | — | — | EP | disclosed |