⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26096414 | 0.95 | — | — | |
| SCHEMBL28905566 | 0.95 | — | — | |
| Lithium Ion SCHEMBL29459175 | 0.95 | — | — | |
| SCHEMBL31182119 | 0.95 | — | — | |
| SCHEMBL28493076 | 0.95 | — | — | |
| Silver SCHEMBL2890032 | 0.95 | — | — | |
| SCHEMBL26098006 | 0.95 | — | — | |
| SCHEMBL5161156 | 0.95 | — | — | |
| Potassium Ion SCHEMBL21373229 | 0.95 | — | — | |
| SCHEMBL26097773 | 0.95 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117820665-A | Copper-based metal-organic framework and preparation method thereof | 江西理工大学 | 2024-04-05 | — | — | CN | disclosed |