⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9634206 | 0.93 | NQO2 (0.46) | — | |
| SCHEMBL9635029 | 0.91 | — | — | |
| SCHEMBL9633761 | 0.91 | GAA (0.46) | — | |
| SCHEMBL9634324 | 0.85 | — | — | |
| SCHEMBL9634171 | 0.85 | PLA2G4A (0.53) | — | |
| SCHEMBL9633708 | 0.84 | NQO2 (0.47) | — | |
| SCHEMBL9633803 | 0.83 | NQO2 (0.48) | — | |
| SCHEMBL9634970 | 0.82 | NQO2 (0.49) | — | |
| SCHEMBL9635009 | 0.81 | — | — | |
| SCHEMBL9634717 | 0.80 | PLA2G4A (0.51) | — |
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-0337765-B1 | ACYLSULFONAMIDE DERIVATIVES OF ALPHA-CARBOCYCLYLTOLUIC ACIDS USED AS LEUKOTRIENE ANTAGONISTS | ICI AMERICAS INC. (US) | 1992-10-14 | — | — | EP | disclosed |
| US-5095038-A | Antiinflammatory, antiallergens | ICI AMERICAS INC. (US) | 1992-03-10 | — | — | US | disclosed |
| EP-0337765-A2 | Acylsulfonamide derivatives of alpha-carbocyclyltoluic acids used as leukotriene antagonists | ICI AMERICAS INC. (US) | 1989-10-18 | — | — | EP | disclosed |