⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16897355 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL7026799 | 0.62 | — | — | |
| SCHEMBL27851811 | 0.62 | — | — | |
| SCHEMBL7208598 | 0.59 | — | — | |
| SCHEMBL13681785 | 0.59 | — | — | |
| SCHEMBL3085691 | 0.57 | — | — | |
| SCHEMBL11471439 | 0.56 | — | — | |
| SCHEMBL11046590 | 0.54 | ALDH1A1 (0.31) | — | |
| SCHEMBL16897218 | 0.54 | — | — | |
| SCHEMBL23366485 | 0.53 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116041346-A | Amine-substituted heterocyclic compounds as EHMT2 inhibitors and methods of use thereof | EPIZYME股份有限公司 | 2023-05-02 | — | — | CN | disclosed |
| CN-110088099-B | Amine-substituted heterocyclic compounds as EHMT2 inhibitors and methods of use thereof | EPIZYME股份有限公司 | 2023-01-31 | — | — | CN | disclosed |