⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7968498 | 0.86 | — | — | |
| SCHEMBL7972402 | 0.84 | MMP12 (0.32) | — | |
| SCHEMBL7968466 | 0.83 | NOTUM (0.39) | — | |
| SCHEMBL6028406 | 0.78 | FPR2 (0.35) | — | |
| SCHEMBL7984718 | 0.73 | CHRNA1 (0.42) | — | |
| SCHEMBL7983353 | 0.73 | CHRNA1 (0.42) | — | |
| SCHEMBL6932927 | 0.73 | CHRNA1 (0.42) | — | |
| SCHEMBL6026628 | 0.72 | MEN1 (0.37) | — | |
| SCHEMBL6934036 | 0.71 | PTGS2 (0.37) | — | |
| SCHEMBL7966664 | 0.71 | HCAR2 (0.46) | — |
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-6265436-B1 | ANTIINFLAMMATORY AGENTS | OXIS THERAPEUTICS INC. | 2001-07-24 | — | — | US | disclosed |