⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12221076 | 0.77 | — | — | |
| SCHEMBL21192000 | 0.73 | — | — | |
| SCHEMBL24519641 | 0.73 | RGS4 (0.32) | — | |
| SCHEMBL21185808 | 0.67 | — | — | |
| SCHEMBL21185523 | 0.67 | AURKA (0.31) | — | |
| SCHEMBL21185802 | 0.66 | TXNRD1 (0.31) | — | |
| SCHEMBL133474 | 0.64 | GSK3A (0.39) | — | |
| SCHEMBL12243991 | 0.63 | ALDH1A1 (0.37) | — | |
| SCHEMBL12221070 | 0.63 | KDM4E (0.35) | — | |
| SCHEMBL21185815 | 0.62 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8039532-B2 | Heterocyclic compound, ultraviolet absorbent and composition containing the same | FUJIFILM CORPORATION (JP) | 2011-10-18 | — | — | US | disclosed |
| US-20100210762-A1 | HETEROCYCLIC COMPOUND, ULTRAVIOLET ABSORBENT AND COMPOSITION CONTAINING THE SAME | FUJIFILM CORPORATION (JP) | 2010-08-19 | — | — | US | disclosed |