⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11824109 | 0.77 | — | — | |
| SCHEMBL9516696 | 0.74 | — | — | |
| SCHEMBL4730629 | 0.72 | — | — | |
| SCHEMBL780809 | 0.72 | — | — | |
| Methylamine SCHEMBL5559367 | 0.72 | — | — | |
| SCHEMBL5354 | 0.71 | — | — | |
| SCHEMBL28827697 | 0.69 | TDP1 (0.38) | — | |
| SCHEMBL1269698 | 0.69 | — | — | |
| SCHEMBL820988 | 0.69 | LMNA (0.30) | — | |
| SCHEMBL680527 | 0.69 | TDP1 (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114144407-B | Process for producing cyclic disulfonate compound | 住友精化株式会社 | 2024-02-13 | — | — | CN | disclosed |
| CN-114144407-A | Process for producing cyclic disulfonate compound | 住友精化株式会社 | 2022-03-04 | — | — | CN | disclosed |
| CN-114144406-A | Method for producing methylene disulfonate compound | 住友精化株式会社 | 2022-03-04 | — | — | CN | disclosed |
| CN-103080099-A | Method for producing a methylene disulfonate compound | SUMITOMO SEIKA CHEMICALS | 2013-05-01 | — | — | CN | disclosed |