⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25048410 | 0.91 | HCRTR1 (0.30) | — | |
| SCHEMBL31617985 | 0.89 | CA2 (0.31) | — | |
| SCHEMBL25048412 | 0.88 | HCRTR1 (0.30) | — | |
| SCHEMBL25048574 | 0.85 | ADK (0.32) | — | |
| SCHEMBL30941221 | 0.81 | — | — | |
| SCHEMBL30941400 | 0.80 | CA2 (0.31) | — | |
| SCHEMBL31617897 | 0.80 | CA2 (0.31) | — | |
| SCHEMBL31617898 | 0.80 | CA2 (0.31) | — | |
| SCHEMBL31617889 | 0.78 | METTL3 (0.37) | — | |
| SCHEMBL31617940 | 0.78 | ADK (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 |
|---|---|---|---|---|---|---|---|
| US-20250188110-A1 | SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION | ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) | 2025-06-12 | — | — | US | disclosed |