⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28057886 | 0.87 | — | — | |
| SCHEMBL27952300 | 0.87 | — | — | |
| SCHEMBL453834 | 0.87 | — | — | |
| SCHEMBL11816466 | 0.75 | — | — | |
| SCHEMBL29033964 | 0.75 | — | — | |
| Phosphine SCHEMBL28821002 | 0.75 | — | — | |
| SCHEMBL5544265 | 0.75 | — | — | |
| SCHEMBL22363163 | 0.75 | — | — | |
| SCHEMBL21776491 | 0.75 | — | — | |
| SCHEMBL2066356 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111272797-B | Mineral exploration method for judging mineralization of granite body by using zircon | 中南大学 | 2021-06-25 | — | — | CN | disclosed |
| CN-111272797-A | Mineral exploration method for judging mineralization of granite body by using zircon | 中南大学 | 2020-06-12 | — | — | CN | disclosed |