⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8663021 | 0.69 | XIAP (0.37) | — | |
| SCHEMBL2192391 | 0.69 | HKDC1 (0.41) | — | |
| SCHEMBL14467763 | 0.67 | — | — | |
| SCHEMBL21886410 | 0.67 | KDM4E (0.33) | — | |
| SCHEMBL867457 | 0.66 | — | — | |
| SCHEMBL8116900 | 0.63 | — | — | |
| SCHEMBL14520353 | 0.63 | KDM4E (0.30) | — | |
| SCHEMBL28875633 | 0.58 | KDM4E (0.43) | — | |
| Tetroquinone SCHEMBL167587 | 0.58 | KDM4E (1.00) | — | |
| SCHEMBL11135771 | 0.56 | KDM4E (0.42) | — |
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-20130122367-A1 | LITHIUM PRIMARY CELL | PANASONIC CORPORATION (JP) | 2013-05-16 | — | — | US | disclosed |