⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22560656 | 0.82 | — | — | |
| SCHEMBL19704560 | 0.74 | DPP4 (0.32) | — | |
| SCHEMBL10089709 | 0.73 | GABRA2 (0.42) | — | |
| SCHEMBL25485199 | 0.72 | AR (0.30) | — | |
| SCHEMBL25624551 | 0.71 | — | — | |
| SCHEMBL19703658 | 0.71 | — | — | |
| SCHEMBL23265113 | 0.71 | TSHR (0.31) | — | |
| SCHEMBL18623676 | 0.70 | AR (0.49) | — | |
| SCHEMBL15491906 | 0.70 | AR (0.31) | — | |
| SCHEMBL18812340 | 0.70 | AR (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11059815-B2 | Synthesis of small molecule histone deacetylase 6 degraders, compounds formed thereby, and pharmaceutical compositions containing them | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2021-07-13 | — | — | US | disclosed |
| US-20200190079-A1 | SYNTHESIS OF SMALL MOLECULE HISTONE DEACETYLASE 6 DEGRADERS, COMPOUNDS FORMED THEREBY, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | WISCONSIN ALUMNI RESEARCH FOUNDATION | 2020-06-18 | — | — | US | disclosed |