⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5718742 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL5518177 | 0.89 | FDPS (0.32) | — | |
| Iodide SCHEMBL6853621 | 0.89 | FDPS (0.32) | — | |
| Bromide SCHEMBL2947343 | 0.89 | FDPS (0.32) | — | |
| Thiocyanic Acid SCHEMBL16109299 | 0.84 | — | — | |
| SCHEMBL28025389 | 0.84 | — | — | |
| SCHEMBL15052311 | 0.84 | — | — | |
| Sulfuric Acid SCHEMBL7997219 | 0.81 | FDPS (0.34) | — | |
| SCHEMBL28760035 | 0.81 | FDPS (0.34) | — | |
| Acetic Acid SCHEMBL28760061 | 0.79 | FDPS (0.36) | — |
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-114624312-A | Preparation method of solid electrolyte flexible material and electrochemical gas sensor | 郑州大学 | 2022-06-14 | — | — | CN | claimed |
| CN-114624312-A | Preparation method of solid electrolyte flexible material and electrochemical gas sensor | 郑州大学 | 2022-06-14 | — | — | CN | disclosed |