⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10984129 | 0.69 | — | — | |
| SCHEMBL1007930 | 0.64 | — | — | |
| SCHEMBL11497234 | 0.61 | — | — | |
| SCHEMBL2396413 | 0.61 | ALDH1A1 (0.43) | — | |
| SCHEMBL4722200 | 0.61 | — | — | |
| SCHEMBL11667263 | 0.60 | — | — | |
| SCHEMBL1624105 | 0.57 | KMT2A (0.54) | — | |
| SCHEMBL157403 | 0.57 | KMT2A (0.33) | — | |
| SCHEMBL323666 | 0.53 | — | — | |
| SCHEMBL2287609 | 0.52 | KMT2A (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-7129021-B2 | Polymer system with switchable physical properties and its use in direct exposure printing plates | CREO SRL (BB) | 2006-10-31 | — | — | US | disclosed |
| US-20040081911-A1 | Polymer system with switchable physical properties and its use in direct exposure printing plates | CREO SRL (CA) | 2004-04-29 | — | — | US | disclosed |