⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6905749 | 0.73 | THRB (0.36) | — | |
| SCHEMBL6906483 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL152168 | 0.70 | TSHR (0.41) | — | |
| SCHEMBL6903420 | 0.67 | THRB (0.35) | — | |
| SCHEMBL149918 | 0.66 | THRB (0.36) | — | |
| SCHEMBL9504845 | 0.66 | TSHR (0.34) | — | |
| SCHEMBL27755602 | 0.66 | — | — | |
| SCHEMBL7638251 | 0.66 | TSHR (0.37) | — | |
| SCHEMBL152169 | 0.66 | TSHR (0.39) | — | |
| SCHEMBL9696445 | 0.65 | TSHR (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0403096-B1 | High speed photopolymerizable printing plate with initiator in a topcoat | MINNESOTA MINING & MFG (US) | 1996-08-14 | — | — | EP | disclosed |
| US-4988607-A | Printing plate composition for multilayer elements, good shelf life | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1991-01-29 | — | — | US | disclosed |
| EP-0403096-A2 | High speed photopolymerizable printing plate with initiator in a topcoat | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1990-12-19 | — | — | EP | disclosed |