⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10082822 | 0.66 | — | — | |
| SCHEMBL13829616 | 0.66 | — | — | |
| SCHEMBL18623607 | 0.65 | — | — | |
| SCHEMBL25667207 | 0.63 | TSHR (0.32) | — | |
| SCHEMBL9576911 | 0.62 | — | — | |
| SCHEMBL13443752 | 0.61 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL21306176 | 0.61 | CA12 (0.33) | — | |
| SCHEMBL7433060 | 0.61 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL13443753 | 0.61 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL19006344 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4129402-A1 | HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF | Mitsubishi Tanabe Pharma Corporation (JP) | 2023-02-08 | — | — | EP | disclosed |