⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9140462 | 0.81 | TSHR (0.31) | — | |
| SCHEMBL9140593 | 0.78 | — | — | |
| SCHEMBL8007480 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL29963060 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL8466685 | 0.76 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL8006569 | 0.76 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL8004141 | 0.76 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL16268474 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL29962886 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL29671481 | 0.70 | MEN1 (0.33) | — |
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-117202984-A | Polyimide porous film | 东京应化工业株式会社 | 2023-12-08 | — | — | CN | disclosed |