⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23891729 | 0.82 | EP300 (0.33) | — | |
| SCHEMBL23891586 | 0.80 | EP300 (0.38) | — | |
| SCHEMBL23891727 | 0.78 | EP300 (0.45) | — | |
| SCHEMBL22040148 | 0.77 | NR1H2 (0.35) | — | |
| SCHEMBL22040787 | 0.71 | PGR (0.39) | — | |
| SCHEMBL23891742 | 0.70 | TSHR (0.34) | — | |
| SCHEMBL22039460 | 0.69 | EP300 (0.61) | — | |
| SCHEMBL23891569 | 0.68 | EP300 (0.41) | — | |
| SCHEMBL23891672 | 0.65 | CCKBR (0.34) | — | |
| SCHEMBL23891707 | 0.64 | EP300 (0.49) | — |
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-3889138-A1 | HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF | Hinova Pharmaceuticals Inc. (CN) | 2021-10-06 | — | — | EP | disclosed |