⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12786907 | 0.78 | — | — | |
| SCHEMBL28376259 | 0.67 | — | — | |
| SCHEMBL17611842 | 0.65 | CA1 (0.43) | — | |
| SCHEMBL28266963 | 0.61 | — | — | |
| Hydrazine SCHEMBL11420618 | 0.57 | — | — | |
| Sulfuric Acid SCHEMBL1446385 | 0.56 | CA5A (0.67) | — | |
| Sulfuric Acid SCHEMBL1446387 | 0.56 | — | — | |
| SCHEMBL5093119 | 0.56 | — | — | |
| SCHEMBL2760745 | 0.54 | CA2 (0.44) | — | |
| SCHEMBL7253508 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020240392-A1 | PROCESS FOR PREPARATION OF PYROXASULFONE | PI INDUSTRIES LIMITED (IN) | 2020-12-03 | — | — | WO | claimed |
| WO-2020240392-A1 | PROCESS FOR PREPARATION OF PYROXASULFONE | PI INDUSTRIES LIMITED (IN) | 2020-12-03 | — | — | WO | disclosed |