⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28281887 | 0.87 | — | — | |
| SCHEMBL1756557 | 0.87 | — | — | |
| SCHEMBL28062742 | 0.87 | — | — | |
| SCHEMBL27927446 | 0.87 | — | — | |
| SCHEMBL27995484 | 0.87 | — | — | |
| SCHEMBL25247569 | 0.75 | — | — | |
| SCHEMBL11058442 | 0.75 | — | — | |
| SCHEMBL8817124 | 0.75 | — | — | |
| SCHEMBL10493887 | 0.75 | — | — | |
| SCHEMBL29062036 | 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-104342729-B | Ni-Mo-Al-rear earth coating and preparation method thereof | 上海应用技术学院 | 2017-01-18 | — | — | CN | disclosed |
| CN-104342729-A | Ni-Mo-Al-rear earth coating and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2015-02-11 | — | — | CN | disclosed |