⚠ 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 | |
|---|---|---|---|---|
| Phosphine SCHEMBL306494 | 0.87 | — | — | |
| Phosphine SCHEMBL374067 | 0.87 | — | — | |
| SCHEMBL12004467 | 0.87 | — | — | |
| Phosphine SCHEMBL29130814 | 0.87 | — | — | |
| Methane SCHEMBL23121383 | 0.75 | — | — | |
| SCHEMBL21328558 | 0.75 | — | — | |
| SCHEMBL11816466 | 0.75 | — | — | |
| Phosphine SCHEMBL5822352 | 0.75 | — | — | |
| SCHEMBL18862924 | 0.75 | — | — | |
| Phosphine SCHEMBL4354647 | 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 |
|---|---|---|---|---|---|---|---|
| US-5484494-A | Amorphous alloy and method for its production | MITSUBISHI RAYON COMPANY, INC. (JP) | 1996-01-16 | — | — | US | disclosed |