⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31694269 | 0.98 | — | — | |
| SCHEMBL31694200 | 0.95 | — | — | |
| SCHEMBL31694272 | 0.90 | CA12 (0.35) | — | |
| SCHEMBL31694294 | 0.88 | CA12 (0.42) | — | |
| SCHEMBL31694277 | 0.88 | CA12 (0.34) | — | |
| SCHEMBL31694242 | 0.87 | HPGD (0.30) | — | |
| SCHEMBL31694233 | 0.87 | CA12 (0.42) | — | |
| SCHEMBL31694210 | 0.87 | CA12 (0.42) | — | |
| SCHEMBL31694255 | 0.87 | CA12 (0.41) | — | |
| SCHEMBL31694247 | 0.85 | ALDH1A1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025204124-A1 | METHOD FOR PRODUCING POLYMER | ＡＧＣ株式会社 | 2025-10-02 | — | — | WO | disclosed |