⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1771685 | 0.96 | CCR1 (0.71) | — | |
| SCHEMBL9611 | 0.96 | — | — | |
| SCHEMBL30421349 | 0.96 | — | — | |
| Hydrogen Sulfide SCHEMBL20214420 | 0.93 | — | — | |
| SCHEMBL17822110 | 0.93 | — | — | |
| Iodide SCHEMBL8148528 | 0.93 | — | — | |
| Fluoride SCHEMBL38652089 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL18983640 | 0.93 | — | — | |
| SCHEMBL184761 | 0.93 | — | — | |
| Bromide SCHEMBL5437785 | 0.93 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118307595-A | Photosensitive dye/catalyst assembled electrode and preparation method and application thereof | 大连理工大学 | 2024-07-09 | — | — | CN | claimed |
| CN-118307595-A | Photosensitive dye/catalyst assembled electrode and preparation method and application thereof | 大连理工大学 | 2024-07-09 | — | — | CN | disclosed |
| CN-118307595-A | Photosensitive dye/catalyst assembled electrode and preparation method and application thereof | 大连理工大学 | 2024-07-09 | — | — | CN | disclosed |