⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30640643 | 0.70 | — | — | |
| SCHEMBL1788083 | 0.66 | — | — | |
| SCHEMBL29349099 | 0.63 | — | — | |
| SCHEMBL1583733 | 0.61 | — | — | |
| SCHEMBL11076521 | 0.61 | — | — | |
| SCHEMBL6850109 | 0.59 | OR51E2 (0.39) | — | |
| 2-Pyrrolidone SCHEMBL27573765 | 0.59 | OR51E2 (0.71) | — | |
| 2-Pyrrolidone SCHEMBL28916954 | 0.56 | OR51E2 (0.65) | — | |
| Caprolactam SCHEMBL28211534 | 0.56 | CRBN (0.70) | — | |
| SCHEMBL900383 | 0.56 | CRBN (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0552360-A1 | A COMPOSITION AND METHOD FOR SIMULTANEOUS ABSORPTION OF SULFUR DIOXIDE AND NITRIC OXIDE | THE DOW CHEMICAL COMPANY (US) | 1993-07-28 | — | — | EP | claimed |
| WO-1993003825-A1 | A COMPOSITION AND METHOD FOR SIMULTANEOUS ABSORPTION OF SULFUR DIOXIDE AND NITRIC OXIDE | THE DOW CHEMICAL COMPANY (US) | 1993-03-04 | — | — | WO | claimed |
| US-5167941-A | Sulfur dioxide; cationic polyelectrolyte stabilizers | THE DOW CHEMICAL COMPANY (US) | 1992-12-01 | — | — | US | claimed |