⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7026469 | 0.67 | — | — | |
| SCHEMBL11502193 | 0.67 | — | — | |
| SCHEMBL16002354 | 0.67 | — | — | |
| SCHEMBL2218395 | 0.64 | — | — | |
| SCHEMBL3644519 | 0.64 | — | — | |
| SCHEMBL10397628 | 0.64 | — | — | |
| SCHEMBL2220091 | 0.61 | — | — | |
| SCHEMBL7593787 | 0.61 | — | — | |
| SCHEMBL5804483 | 0.57 | — | — | |
| SCHEMBL10627054 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4333883-A | Preparation of N-chlorothio(methyl)carbamoyl halides | THE UPJOHN COMPANY (US) | 1982-06-08 | — | — | US | disclosed |
| US-4066689-A | KETOALKANESULFENYLCARBAMOYL AND KETOALKANETHIOSULFENYLCARBAMOYL HALIDES | UNION CARBIDE CORPORATION (US) | 1978-01-03 | — | — | US | disclosed |