⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL825525 | 0.97 | ATP1A1 (0.32) | — | |
| SCHEMBL12676938 | 0.81 | ALOX15 (0.36) | — | |
| SCHEMBL23493846 | 0.80 | CYP1A2 (0.31) | — | |
| SCHEMBL12834130 | 0.79 | ALDH1A1 (0.31) | — | |
| SCHEMBL25120603 | 0.79 | — | — | |
| SCHEMBL10005764 | 0.78 | ALOX15 (0.36) | — | |
| SCHEMBL23494297 | 0.77 | CYP1A2 (0.39) | — | |
| SCHEMBL13713892 | 0.77 | — | — | |
| SCHEMBL825398 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL14519268 | 0.76 | — | — |
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-1975713-A2 | Positive resist composition and pattern forming method using the same | FUJIFILM Corporation (JP) | 2008-10-01 | — | — | EP | disclosed |