⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9540245 | 1.00 | — | — | |
| SCHEMBL28573369 | 0.89 | — | — | |
| SCHEMBL453526 | 0.87 | — | — | |
| SCHEMBL11444358 | 0.87 | — | — | |
| SCHEMBL1814221 | 0.87 | — | — | |
| SCHEMBL454822 | 0.87 | — | — | |
| SCHEMBL453524 | 0.87 | — | — | |
| SCHEMBL11444359 | 0.87 | — | — | |
| SCHEMBL31668854 | 0.87 | — | — | |
| SCHEMBL19182484 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993007302-A1 | OXIDATION-RESISTANT REFRACTORY METAL ALLOYS | BATTELLE MEMORIAL INSTITUTE (US) | 1993-04-15 | — | — | WO | disclosed |