⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL728620 | 0.82 | — | — | |
| SCHEMBL29364258 | 0.82 | — | — | |
| SCHEMBL767054 | 0.82 | — | — | |
| SCHEMBL31276948 | 0.82 | — | — | |
| Water SCHEMBL23234060 | 0.67 | — | — | |
| SCHEMBL9243255 | 0.67 | — | — | |
| SCHEMBL11835790 | 0.67 | — | — | |
| SCHEMBL11530263 | 0.67 | — | — | |
| SCHEMBL9630575 | 0.67 | — | — | |
| SCHEMBL4259759 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0562404-A2 | Corrosion resistant zirconium liner for nuclear fuel rod cladding | Siemens Power Corporation (US) | 1993-09-29 | — | — | EP | claimed |
| US-5247550-A | Liner has inner diffusion zones | SIEMENS POWER CORPORATION (US) | 1993-09-21 | — | — | US | claimed |
| EP-0562404-A2 | Corrosion resistant zirconium liner for nuclear fuel rod cladding | Siemens Power Corporation (US) | 1993-09-29 | — | — | EP | disclosed |
| US-5247550-A | Liner has inner diffusion zones | SIEMENS POWER CORPORATION (US) | 1993-09-21 | — | — | US | disclosed |