⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11598282 | 0.95 | — | — | |
| SCHEMBL22096308 | 0.87 | — | — | |
| SCHEMBL13515204 | 0.87 | PTPN1 (0.32) | — | |
| SCHEMBL14629775 | 0.84 | — | — | |
| SCHEMBL7939033 | 0.81 | — | — | |
| SCHEMBL14629777 | 0.78 | — | — | |
| SCHEMBL19299976 | 0.78 | LTA4H (0.42) | — | |
| SCHEMBL19189075 | 0.77 | — | — | |
| SCHEMBL446703 | 0.77 | — | — | |
| SCHEMBL17993741 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019173428-A1 | POLYARYLETHERKETONE COMPOSITION | TICONA LLC (US) | 2019-09-12 | — | — | WO | disclosed |