⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13865253 | 0.88 | — | — | |
| SCHEMBL3338321 | 0.72 | — | — | |
| SCHEMBL1232048 | 0.72 | SLC6A4 (0.31) | — | |
| SCHEMBL4807341 | 0.72 | — | — | |
| SCHEMBL646221 | 0.72 | — | — | |
| SCHEMBL11989444 | 0.70 | — | — | |
| SCHEMBL16501810 | 0.70 | — | — | |
| SCHEMBL9350936 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL1232635 | 0.70 | ACHE (0.32) | — | |
| SCHEMBL14354627 | 0.70 | — | — |
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-20230227644-A1 | POLYMER COMPOSITION WITH IMPROVED STORAGE STABILITY | BOREALIS AG (AT) | 2023-07-20 | — | — | US | disclosed |