⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12868920 | 0.85 | — | — | |
| SCHEMBL10016729 | 0.84 | PPARG (0.32) | — | |
| SCHEMBL13053702 | 0.83 | — | — | |
| SCHEMBL12705184 | 0.83 | — | — | |
| SCHEMBL10061185 | 0.79 | ABCB1 (0.32) | — | |
| SCHEMBL12764998 | 0.76 | CYP19A1 (0.32) | — | |
| SCHEMBL14560956 | 0.75 | — | — | |
| SCHEMBL12869724 | 0.74 | CYP19A1 (0.33) | — | |
| SCHEMBL685122 | 0.74 | — | — | |
| SCHEMBL686162 | 0.74 | — | — |
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-1367439-B1 | Radiation-sensitive composition | FUJIFILM CORP (JP) | 2012-08-01 | — | — | EP | disclosed |