⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9049989 | 1.00 | — | — | |
| SCHEMBL9074050 | 0.89 | — | — | |
| SCHEMBL9076299 | 0.83 | ALOX5 (0.30) | — | |
| SCHEMBL9050113 | 0.83 | ALOX5 (0.30) | — | |
| SCHEMBL9076298 | 0.83 | ALOX5 (0.30) | — | |
| SCHEMBL9074809 | 0.82 | POLB (0.30) | — | |
| SCHEMBL9074807 | 0.82 | POLB (0.30) | — | |
| SCHEMBL9076715 | 0.81 | ALOX5 (0.31) | — | |
| SCHEMBL9051325 | 0.81 | ALOX5 (0.31) | — | |
| SCHEMBL9077212 | 0.81 | ALOX5 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5482966-A | LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS | ZENECA LIMITED (GB) | 1996-01-09 | — | — | US | disclosed |
| US-5332757-A | Enzyme inhibitors | ZENECA LIMITED (GB) | 1994-07-26 | — | — | US | disclosed |