⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12527136 | 0.79 | — | — | |
| SCHEMBL23592777 | 0.79 | — | — | |
| SCHEMBL7888308 | 0.75 | — | — | |
| SCHEMBL15257872 | 0.75 | — | — | |
| SCHEMBL15925070 | 0.74 | KDM1A (0.30) | — | |
| SCHEMBL13537114 | 0.73 | SLC6A2 (0.32) | — | |
| SCHEMBL15925106 | 0.73 | — | — | |
| SCHEMBL21216434 | 0.72 | — | — | |
| SCHEMBL21216408 | 0.72 | — | — | |
| SCHEMBL23089275 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2473499-A1 | BIPYRIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES | Novartis AG (CH) | 2012-07-11 | — | — | EP | disclosed |