⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28324267 | 0.97 | CA12 (0.50) | — | |
| SCHEMBL135628 | 0.97 | — | — | |
| SCHEMBL7620382 | 0.95 | — | — | |
| SCHEMBL673638 | 0.95 | — | — | |
| SCHEMBL153268 | 0.95 | — | — | |
| SCHEMBL671988 | 0.95 | — | — | |
| SCHEMBL180552 | 0.95 | — | — | |
| SCHEMBL639834 | 0.95 | — | — | |
| SCHEMBL11436649 | 0.95 | — | — | |
| SCHEMBL2579287 | 0.95 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5714391-A | THERMALLY DECOMPOSING SULFUR-CONTAINING METAL ORGANIC COMPOUND | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1998-02-03 | — | — | US | disclosed |