⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17527173 | 0.80 | — | — | |
| SCHEMBL26558286 | 0.70 | — | — | |
| SCHEMBL22461598 | 0.70 | — | — | |
| SCHEMBL30953663 | 0.64 | — | — | |
| SCHEMBL13757871 | 0.61 | — | — | |
| SCHEMBL24931066 | 0.60 | — | — | |
| SCHEMBL24220645 | 0.60 | — | — | |
| SCHEMBL249642 | 0.57 | — | — | |
| SCHEMBL13360255 | 0.56 | — | — | |
| SCHEMBL13207494 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2746285-A1 | Process for the preparation of aurora kinase inhibitors | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2014-06-25 | — | — | EP | disclosed |
| WO-2008082484-A1 | 4,5-RING ANNULATED INDOLE DERIVATIVES FOR TREATING OR PREVENTING OF HCV AND RELATED VIRAL INFECTIONS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |