⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7673392 | 0.82 | — | — | |
| SCHEMBL4077675 | 0.82 | — | — | |
| SCHEMBL3348950 | 0.82 | — | — | |
| SCHEMBL9631047 | 0.82 | — | — | |
| SCHEMBL7104002 | 0.82 | — | — | |
| SCHEMBL108727 | 0.82 | — | — | |
| SCHEMBL30989113 | 0.82 | — | — | |
| SCHEMBL1993308 | 0.82 | — | — | |
| Phosphine SCHEMBL4077671 | 0.67 | — | — | |
| SCHEMBL373749 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116856035-A | Rare earth doped composite coating and preparation method and application thereof | 中国科学院赣江创新研究院 | 2023-10-10 | — | — | CN | disclosed |