⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8572699 | 1.00 | — | — | |
| SCHEMBL4646780 | 1.00 | — | — | |
| SCHEMBL8615760 | 0.94 | — | — | |
| SCHEMBL6264638 | 0.80 | — | — | |
| SCHEMBL3617970 | 0.78 | — | — | |
| SCHEMBL1686636 | 0.78 | — | — | |
| SCHEMBL15352495 | 0.78 | — | — | |
| SCHEMBL3623150 | 0.78 | — | — | |
| SCHEMBL5607519 | 0.78 | — | — | |
| SCHEMBL5607628 | 0.78 | — | — |
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-113166043-A | Electrolyte for sulfur-based magnesium battery | 富士胶片和光纯药株式会社 | 2021-07-23 | — | — | CN | disclosed |
| CN-105764885-A | Acid- and radical-generating agent and method for generating acid and radical | 和光纯药工业株式会社 | 2016-07-13 | — | — | CN | disclosed |