⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7583103 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL21119304 | 0.67 | ALDH1A1 (0.41) | — | |
| SCHEMBL27810848 | 0.65 | — | — | |
| SCHEMBL28159289 | 0.63 | — | — | |
| SCHEMBL27471653 | 0.63 | ALDH1A1 (0.30) | — | |
| Water SCHEMBL20657273 | 0.63 | — | — | |
| SCHEMBL269951 | 0.60 | — | — | |
| SCHEMBL9929859 | 0.60 | — | — | |
| SCHEMBL9930285 | 0.60 | — | — | |
| SCHEMBL4598634 | 0.59 | TSHR (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0509149-B1 | Thermal dye sublimation transfer receiving element | AGFA GEVAERT NV (BE) | 1996-03-13 | — | — | EP | disclosed |
| US-5284815-A | Image-receiving layer containing an isocyanate-based polymer having a crosslinked and cured surface; dyeability; releasability from the dye donor element | AGFA-GEVAERT, N.V. (BE) | 1994-02-08 | — | — | US | disclosed |
| EP-0509149-A1 | Thermal dye sublimation transfer receiving element | AGFA-GEVAERT N.V. (BE) | 1992-10-21 | — | — | EP | disclosed |