⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL635259 | 0.79 | — | — | |
| SCHEMBL10638500 | 0.78 | — | — | |
| SCHEMBL27410036 | 0.78 | — | — | |
| SCHEMBL6652022 | 0.70 | MEN1 (0.38) | — | |
| SCHEMBL9596060 | 0.65 | — | — | |
| SCHEMBL158857 | 0.64 | — | — | |
| SCHEMBL992630 | 0.64 | — | — | |
| SCHEMBL1373112 | 0.64 | — | — | |
| SCHEMBL3128245 | 0.64 | — | — | |
| SCHEMBL29955605 | 0.62 | CYP2D6 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025016138-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | SUZHOU EOC MEDICAL RESEARCH CO., LTD. (CN) | 2025-01-23 | — | — | WO | disclosed |