⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3464753 | 0.81 | KDM4E (0.41) | — | |
| SCHEMBL4623912 | 0.81 | METAP2 (0.35) | — | |
| SCHEMBL3226179 | 0.79 | KDR (0.35) | — | |
| SCHEMBL4190285 | 0.78 | CSNK1A1 (0.42) | — | |
| SCHEMBL9323558 | 0.77 | PIK3CD (0.47) | — | |
| SCHEMBL9763542 | 0.77 | PDE5A (0.57) | — | |
| SCHEMBL434158 | 0.76 | METAP2 (0.43) | — | |
| SCHEMBL810755 | 0.76 | METAP1 (0.40) | — | |
| SCHEMBL6489268 | 0.72 | BCHE (0.40) | — | |
| SCHEMBL4988840 | 0.72 | METAP2 (0.30) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11981822-B2 | Crosslinked coating compositions for packaging articles such as food and beverage containers | SWIMC LLC (US) | 2024-05-14 | — | — | US | disclosed |
| US-7288550-B2 | Thioether substituted imidazoquinolines | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-10-30 | — | — | US | disclosed |
| US-20050209267-A1 | Thioether substituted imidazoquinolines | 3M INNOVATIVE PROPERTIES COMPANY | 2005-09-22 | — | — | US | disclosed |