⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13683555 | 0.81 | RECQL (0.32) | — | |
| SCHEMBL14016516 | 0.71 | — | — | |
| SCHEMBL10270912 | 0.59 | MAPT (0.50) | — | |
| SCHEMBL13683641 | 0.56 | RECQL (0.55) | — | |
| SCHEMBL13683583 | 0.54 | MEN1 (0.47) | — | |
| SCHEMBL13683582 | 0.54 | MEN1 (0.45) | — | |
| SCHEMBL14016100 | 0.53 | MEN1 (0.35) | — | |
| SCHEMBL13651910 | 0.52 | — | — | |
| SCHEMBL17342934 | 0.49 | MAPT (0.34) | — | |
| SCHEMBL13974402 | 0.48 | RECQL (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1619040-B1 | Thermal transfer recording material and thermal transfer recording method | DAINIPPON PRINTING CO LTD (JP) | 2008-11-19 | — | — | EP | disclosed |