⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13519551 | 0.78 | — | — | |
| SCHEMBL5861546 | 0.63 | — | — | |
| SCHEMBL14389637 | 0.50 | — | — | |
| SCHEMBL702562 | 0.50 | — | — | |
| SCHEMBL14641572 | 0.49 | — | — | |
| SCHEMBL2042755 | 0.49 | — | — | |
| SCHEMBL15737899 | 0.46 | — | — | |
| SCHEMBL1554079 | 0.45 | — | — | |
| SCHEMBL12653231 | 0.45 | S100A4 (0.40) | — | |
| SCHEMBL37684 | 0.45 | — | — |
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-2682272-B1 | INK JET RECORDING METHOD AND PRINTED MATERIAL | FUJIFILM CORP (JP) | 2015-08-26 | — | — | EP | disclosed |