⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29123353 | 0.94 | — | — | |
| SCHEMBL28357154 | 0.82 | TSHR (0.40) | — | |
| SCHEMBL9760486 | 0.77 | THRB (0.32) | — | |
| SCHEMBL28357156 | 0.75 | TSHR (0.40) | — | |
| SCHEMBL229915 | 0.74 | THRB (0.33) | — | |
| SCHEMBL229913 | 0.74 | THRB (0.33) | — | |
| SCHEMBL9760478 | 0.72 | THRB (0.32) | — | |
| SCHEMBL15809573 | 0.72 | DNM1 (0.38) | — | |
| SCHEMBL28713075 | 0.69 | — | — | |
| SCHEMBL28713071 | 0.69 | THRB (0.32) | — |
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-110028666-B | Polyimide precursor and resin composition containing same | 旭化成株式会社 | 2021-11-09 | — | — | CN | disclosed |