⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1011084 | 0.72 | — | — | |
| SCHEMBL27428693 | 0.71 | — | — | |
| SCHEMBL18218172 | 0.70 | CTSK (0.37) | — | |
| SCHEMBL26558436 | 0.67 | — | — | |
| SCHEMBL11725437 | 0.66 | — | — | |
| SCHEMBL23709967 | 0.65 | — | — | |
| SCHEMBL28534870 | 0.65 | — | — | |
| SCHEMBL1012319 | 0.65 | — | — | |
| SCHEMBL15417150 | 0.65 | FAAH (0.35) | — | |
| SCHEMBL10088108 | 0.64 | MGAM (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230331912-A1 | POLYETHER DERIVATIVE AND PREPARATION METHOD THEREFOR | GUANGDONG UNIVERSITY OF PETROCHEMICAL TECHNOLOGY (CN) | 2023-10-19 | — | — | US | disclosed |