⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17072788 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL9889189 | 0.85 | PTPN1 (0.32) | — | |
| SCHEMBL21081502 | 0.85 | PTPN1 (0.32) | — | |
| SCHEMBL17064148 | 0.83 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL5708888 | 0.78 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL14021448 | 0.75 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL5708919 | 0.75 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL2581832 | 0.75 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL783191 | 0.70 | — | — | |
| SCHEMBL13203925 | 0.70 | LMNA (0.34) | — |
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-20080090174-A1 | Novel Oxonol Dye Compounds and Optical Information Recording Medium | FUJIFILM CORPORATION (JP) | 2008-04-17 | — | — | US | disclosed |