⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL200512 | 0.97 | — | — | |
| Ethylene SCHEMBL28167018 | 0.92 | — | — | |
| SCHEMBL5078287 | 0.87 | LMNA (0.31) | — | |
| SCHEMBL3155553 | 0.85 | — | — | |
| SCHEMBL730417 | 0.84 | — | — | |
| SCHEMBL375780 | 0.84 | — | — | |
| Sulfuric Acid SCHEMBL664697 | 0.84 | PTGS1 (0.32) | — | |
| SCHEMBL10883256 | 0.82 | — | — | |
| SCHEMBL25427601 | 0.81 | — | — | |
| SCHEMBL15541 | 0.81 | — | — |
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-107363266-B | The method of the hydride modified copper nano-cluster of one-step synthesis and its detection organic solvent in trace water content application | 浙江师范大学 | 2019-07-26 | — | — | CN | disclosed |