⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13808832 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL13360923 | 0.74 | — | — | |
| SCHEMBL13361082 | 0.73 | LMNA (0.33) | — | |
| SCHEMBL13361021 | 0.73 | EPHX2 (0.31) | — | |
| SCHEMBL13360986 | 0.73 | — | — | |
| SCHEMBL13879050 | 0.73 | — | — | |
| SCHEMBL13360927 | 0.73 | — | — | |
| SCHEMBL13759982 | 0.73 | — | — | |
| SCHEMBL13330726 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL13361034 | 0.72 | MAPK1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100124718-A1 | POLYMERIC COMPOUND, POSITIVE RESIST COMPOSITION, AND METHOD OF FORMING RESITS PATTERN | TOKYO OHKA KOGYO CO., LTD. (JP) | 2010-05-20 | — | — | US | disclosed |