⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29364443 | 0.82 | — | — | |
| SCHEMBL15814 | 0.82 | — | — | |
| SCHEMBL30084553 | 0.82 | — | — | |
| SCHEMBL7620754 | 0.82 | — | — | |
| SCHEMBL21813263 | 0.82 | — | — | |
| SCHEMBL10938130 | 0.67 | — | — | |
| SCHEMBL1737547 | 0.67 | — | — | |
| Water SCHEMBL8366650 | 0.67 | — | — | |
| SCHEMBL11862678 | 0.67 | — | — | |
| Fluoride Ion SCHEMBL11238315 | 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-4252612-A | Nuclear reactors | UNITED KINGDOM ATOMIC ENERGY AUTHORITY (GB) | 1981-02-24 | — | — | US | disclosed |
| US-4005521-A | Locked-wrap fuel rod | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES ENERGY RESEARCH AND DEVELOPMENT ADMINISTRATION (US) | 1977-02-01 | — | — | US | disclosed |