⚠ 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 | |
|---|---|---|---|---|
| Formamide SCHEMBL22089896 | 0.93 | — | — | |
| SCHEMBL28539926 | 0.86 | — | — | |
| SCHEMBL127447 | 0.84 | — | — | |
| Water SCHEMBL29065746 | 0.82 | — | — | |
| Methyl Alcohol SCHEMBL28152581 | 0.79 | — | — | |
| Formamide SCHEMBL28870910 | 0.77 | — | — | |
| Methoxymethane SCHEMBL16053678 | 0.77 | — | — | |
| Bromide SCHEMBL28351972 | 0.77 | — | — | |
| SCHEMBL238816 | 0.76 | — | — | |
| SCHEMBL29189728 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114929681-B | Bicyclic CX3CR1 receptor agonists | 德州大学系统董事会 | 2024-05-14 | — | — | CN | disclosed |
| CN-114929681-A | Bicyclic CX3CR1 receptor agonists | 德州大学系统董事会 | 2022-08-19 | — | — | CN | disclosed |