⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9587503 | 0.89 | — | — | |
| SCHEMBL9586130 | 0.84 | — | — | |
| SCHEMBL9734376 | 0.83 | CYSLTR1 (0.56) | — | |
| SCHEMBL9585948 | 0.82 | CYSLTR1 (0.76) | — | |
| SCHEMBL9733925 | 0.82 | MEN1 (0.54) | — | |
| SCHEMBL9733072 | 0.81 | MEN1 (0.54) | — | |
| SCHEMBL9733078 | 0.81 | MEN1 (0.54) | — | |
| SCHEMBL9733232 | 0.81 | MEN1 (0.54) | — | |
| SCHEMBL9586091 | 0.79 | CYSLTR1 (0.78) | — | |
| SCHEMBL9586503 | 0.78 | CYSLTR1 (0.72) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5248693-A | Antiallergens, antiinflammatory agents | CIBA-GEIGY CORPORATION (US) | 1993-09-28 | — | — | US | disclosed |