⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1276688 | 0.87 | CTSA (0.32) | — | |
| SCHEMBL16924885 | 0.85 | CTSA (0.31) | — | |
| SCHEMBL16924886 | 0.77 | CTSA (0.32) | — | |
| SCHEMBL1009508 | 0.77 | — | — | |
| SCHEMBL1469442 | 0.76 | TSHR (0.37) | — | |
| SCHEMBL14054866 | 0.76 | — | — | |
| SCHEMBL15301253 | 0.74 | — | — | |
| SCHEMBL4950853 | 0.73 | PGK1 (0.35) | — | |
| SCHEMBL14054801 | 0.70 | — | — | |
| SCHEMBL575653 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120171542-A1 | SECONDARY BATTERY | NEC CORPORATION (JP) | 2012-07-05 | — | — | US | disclosed |
| US-20110159379-A1 | SECONDARY BATTERY | NEC CORPORATION (JP) | 2011-06-30 | — | — | US | disclosed |
| US-20110070504-A1 | SECONDARY BATTERY | NEC CORPORATION (JP) | 2011-03-24 | — | — | US | disclosed |