⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14135446 | 0.74 | — | — | |
| SCHEMBL23891813 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL12354692 | 0.65 | — | — | |
| SCHEMBL31674978 | 0.65 | NPC1 (0.33) | — | |
| SCHEMBL22298100 | 0.65 | — | — | |
| SCHEMBL19245103 | 0.65 | — | — | |
| SCHEMBL25002994 | 0.65 | — | — | |
| SCHEMBL23891718 | 0.64 | TSHR (0.39) | — | |
| SCHEMBL19392676 | 0.64 | — | — | |
| SCHEMBL9946179 | 0.63 | — | — |
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 |