⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL172482 | 0.80 | — | — | |
| SCHEMBL149091 | 0.78 | — | — | |
| SCHEMBL903415 | 0.78 | — | — | |
| SCHEMBL18927412 | 0.76 | — | — | |
| SCHEMBL11321495 | 0.76 | — | — | |
| SCHEMBL13057485 | 0.76 | — | — | |
| SCHEMBL19608067 | 0.76 | CES1 (0.34) | — | |
| Zinc Ion SCHEMBL10613130 | 0.74 | CA2 (0.30) | — | |
| SCHEMBL26771874 | 0.74 | F2 (0.30) | — | |
| SCHEMBL10160834 | 0.73 | FFAR1 (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-1795344-B1 | Lithographic printing plate precursor and lithographic printing method | FUJIFILM CORP (JP) | 2008-11-05 | — | — | EP | disclosed |