⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29398010 | 0.82 | — | — | |
| SCHEMBL628082 | 0.82 | — | — | |
| SCHEMBL11498704 | 0.82 | — | — | |
| SCHEMBL29001857 | 0.82 | — | — | |
| SCHEMBL9057984 | 0.67 | — | — | |
| SCHEMBL11660192 | 0.67 | — | — | |
| SCHEMBL8020126 | 0.67 | — | — | |
| SCHEMBL32679347 | 0.67 | — | — | |
| Water SCHEMBL10476764 | 0.67 | — | — | |
| SCHEMBL22577724 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5112534-A | YTTRIUM AND RARE EARTH STABILIZED FAST REACTOR METAL FUEL | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 1992-05-12 | — | — | US | disclosed |
| EP-0450161-A2 | Yttrium and rare earth stabilized fast reactor metal fuel | ROCKWELL INTERNATIONAL CORPORATION (US) | 1991-10-09 | — | — | EP | disclosed |