⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25327947 | 0.92 | — | — | |
| SCHEMBL25329844 | 0.90 | — | — | |
| SCHEMBL25330267 | 0.90 | GABRA1 (0.30) | — | |
| SCHEMBL25329799 | 0.88 | TP53 (0.30) | — | |
| SCHEMBL25328457 | 0.86 | — | — | |
| SCHEMBL25328785 | 0.84 | TP53 (0.30) | — | |
| SCHEMBL25328227 | 0.82 | — | — | |
| SCHEMBL25327553 | 0.77 | IMPDH2 (0.36) | — | |
| SCHEMBL25328557 | 0.75 | CYP1A2 (0.32) | — | |
| SCHEMBL25327966 | 0.70 | ESR1 (0.33) | — |
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-12583813-B2 | Polymerization inhibitors | BASF SE (DE) | 2026-03-24 | — | — | US | disclosed |
| US-20230242472-A1 | POLYMERIZATION INHIBITORS | BASF SE (DE) | 2023-08-03 | — | — | US | disclosed |