⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6070415 | 0.75 | — | — | |
| SCHEMBL7178446 | 0.70 | — | — | |
| SCHEMBL20162190 | 0.70 | — | — | |
| Ammonia Solution, Strong SCHEMBL11557250 | 0.67 | TAS2R38 (0.44) | — | |
| SCHEMBL9417660 | 0.67 | TAS2R38 (0.44) | — | |
| Water SCHEMBL23804500 | 0.67 | TAS2R38 (0.44) | — | |
| SCHEMBL735597 | 0.67 | — | — | |
| SCHEMBL27931909 | 0.67 | — | — | |
| SCHEMBL2514868 | 0.67 | — | — | |
| SCHEMBL21327 | 0.64 | — | — |
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-115772106-A | Diamine bisdithiocarbamic acid sodium salt and preparation method thereof | 西北矿冶研究院 | 2023-03-10 | — | — | CN | disclosed |
| US-7041825-B2 | Additive compound for curing halogenated polymers | R.T. VANDERBILT COMPANY, INC. (US) | 2006-05-09 | — | — | US | disclosed |
| US-20040176504-A1 | Additive compound for curing halogenated polymers | VANDERBILT CHEMICALS, LLC | 2004-09-09 | — | — | US | disclosed |