⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29750045 | 0.85 | — | — | |
| SCHEMBL31566947 | 0.85 | — | — | |
| SCHEMBL6833316 | 0.80 | CRBN (0.50) | — | |
| SCHEMBL17619773 | 0.80 | CRBN (0.55) | — | |
| SCHEMBL5393521 | 0.77 | CRBN (0.68) | — | |
| SCHEMBL29749828 | 0.77 | CRBN (0.52) | — | |
| Oxalic Acid SCHEMBL30036107 | 0.77 | CRBN (0.52) | — | |
| SCHEMBL23199583 | 0.75 | CRBN (0.61) | — | |
| SCHEMBL12501024 | 0.75 | CRBN (0.61) | — | |
| SCHEMBL21238835 | 0.75 | — | — |
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-113226310-B | 15-PGDH inhibitors | 杏林制药株式会社 | 2024-03-19 | — | — | CN | disclosed |