⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6851025 | 0.71 | GSK3B (0.44) | — | |
| SCHEMBL1449417 | 0.67 | GRIN2D (0.36) | — | |
| SCHEMBL1081008 | 0.67 | GSK3B (0.43) | — | |
| SCHEMBL1081926 | 0.65 | GRM5 (0.55) | — | |
| SCHEMBL8733759 | 0.58 | — | — | |
| SCHEMBL20443699 | 0.58 | — | — | |
| SCHEMBL14872072 | 0.58 | — | — | |
| SCHEMBL1677242 | 0.58 | — | — | |
| SCHEMBL13632738 | 0.58 | — | — | |
| SCHEMBL845296 | 0.58 | — | — |
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-4173700-A | Bis (difluoromaleimide) capped propolymers and polymers | TRW INC. (US) | 1979-11-06 | — | — | US | disclosed |