⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6067361 | 0.92 | GPR3 (0.30) | — | |
| SCHEMBL6067024 | 0.81 | — | — | |
| SCHEMBL6066604 | 0.78 | — | — | |
| SCHEMBL6067023 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL6066851 | 0.73 | POLB (0.32) | — | |
| SCHEMBL6067294 | 0.70 | RET (0.30) | — | |
| SCHEMBL6066963 | 0.70 | MAPT (0.33) | — | |
| Hydrochloric Acid SCHEMBL6067372 | 0.69 | POLB (0.30) | — | |
| SCHEMBL6066689 | 0.68 | BCHE (0.33) | — | |
| SCHEMBL6066591 | 0.68 | MAPT (0.35) | — |
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-7148173-B2 | Catalytic systems for the polymerization and copolymerization of alpha-olefins | REPSOL QUIMICA, S.A. (ES) | 2006-12-12 | — | — | US | claimed |
| US-7148173-B2 | Catalytic systems for the polymerization and copolymerization of alpha-olefins | REPSOL QUIMICA, S.A. (ES) | 2006-12-12 | — | — | US | disclosed |