⚠ 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 | |
|---|---|---|---|---|
| Cyanate SCHEMBL639066 | 0.94 | — | — | |
| Cyanate SCHEMBL4201867 | 0.94 | — | — | |
| Cyanate SCHEMBL28411394 | 0.94 | — | — | |
| Cyanate SCHEMBL6829237 | 0.94 | — | — | |
| Cyanate SCHEMBL536200 | 0.94 | — | — | |
| Cyanate SCHEMBL28651441 | 0.88 | — | — | |
| Cyanate SCHEMBL28501845 | 0.88 | — | — | |
| Cyanate SCHEMBL29042165 | 0.88 | — | — | |
| Cyanate SCHEMBL21550222 | 0.88 | — | — | |
| Cyanate SCHEMBL28893530 | 0.88 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104841924-A | Preparation method of carbon entirely-packaged metal nanoparticles | DALIAN CHEMICAL PHYSICS INST | 2015-08-19 | — | — | CN | claimed |
| CN-104841924-B | A kind of preparation method of the fully enclosed metal nanoparticle of carbon | 中国科学院大连化学物理研究所 | 2017-11-21 | — | — | CN | disclosed |
| CN-104841924-A | Preparation method of carbon entirely-packaged metal nanoparticles | DALIAN CHEMICAL PHYSICS INST | 2015-08-19 | — | — | CN | disclosed |