⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16267265 | 0.89 | — | — | |
| SCHEMBL11816466 | 0.89 | — | — | |
| SCHEMBL28338620 | 0.89 | — | — | |
| SCHEMBL29033964 | 0.89 | — | — | |
| SCHEMBL28131621 | 0.80 | — | — | |
| SCHEMBL28573369 | 0.80 | — | — | |
| SCHEMBL31435207 | 0.80 | — | — | |
| SCHEMBL616081 | 0.78 | — | — | |
| SCHEMBL3801632 | 0.78 | — | — | |
| SCHEMBL971079 | 0.78 | — | — |
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-106636865-A | Composite modifier for gray cast iron of tungsten molybdenum cobalt-silicon iron alloy carrying nano zirconium-silicon oxide and preparation method of composite modifier | 钟小苹 | 2017-05-10 | — | — | CN | disclosed |
| CN-106636865-A | Composite modifier for gray cast iron of tungsten molybdenum cobalt-silicon iron alloy carrying nano zirconium-silicon oxide and preparation method of composite modifier | 钟小苹 | 2017-05-10 | — | — | CN | disclosed |