⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL301241 | 1.00 | — | — | |
| SCHEMBL27536355 | 0.82 | — | — | |
| SCHEMBL28518555 | 0.82 | — | — | |
| SCHEMBL28133781 | 0.82 | — | — | |
| SCHEMBL10382481 | 0.82 | — | — | |
| SCHEMBL16689969 | 0.82 | — | — | |
| Iodide SCHEMBL29244063 | 0.82 | — | — | |
| SCHEMBL17459819 | 0.82 | — | — | |
| SCHEMBL11673630 | 0.82 | — | — | |
| SCHEMBL27283085 | 0.82 | — | — |
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-106458834-B | Diphenyl carbonate and method for producing same, catalyst and method for producing, recovering and reusing same, and polycarbonate | 三菱化学株式会社 | 2019-10-25 | — | — | CN | disclosed |