⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4553198 | 0.97 | — | — | |
| SCHEMBL30403473 | 0.94 | — | — | |
| SCHEMBL29703779 | 0.94 | — | — | |
| SCHEMBL5023955 | 0.94 | — | — | |
| Water SCHEMBL17963060 | 0.94 | — | — | |
| SCHEMBL10881440 | 0.94 | — | — | |
| Potassium SCHEMBL31565024 | 0.94 | — | — | |
| SCHEMBL29854422 | 0.94 | — | — | |
| Zinc Ion SCHEMBL10802530 | 0.86 | NOS3 (0.42) | — | |
| SCHEMBL11227209 | 0.86 | NOS3 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-121648080-A | Load diethyl dithiocarbamic acid manganese nanoparticles and pharmaceutical compositions | 华中科技大学 | 2026-03-13 | — | — | CN | disclosed |