⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL700830 | 0.73 | — | — | |
| Sulfuric Acid SCHEMBL8528930 | 0.72 | — | — | |
| SCHEMBL8323333 | 0.70 | CA5A (0.42) | — | |
| SCHEMBL124000 | 0.70 | — | — | |
| SCHEMBL4074218 | 0.67 | CA2 (0.54) | — | |
| Sulfuric Acid SCHEMBL4935184 | 0.67 | — | — | |
| Sulfuric Acid SCHEMBL974191 | 0.67 | — | — | |
| SCHEMBL296743 | 0.67 | — | — | |
| Sulfuric Acid SCHEMBL5933384 | 0.67 | — | — | |
| Sulfuric Acid SCHEMBL28053797 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-4360846-A | — | — | None | — | — | JP | disclosed |
| JP-H04360846-A | PRODUCTION OF VINYLIDENE CHLORIDE | KANEGAFUCHI CHEM IND CO LTD | 1992-12-14 | — | — | JP | disclosed |