⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL343242 | 0.84 | — | — | |
| SCHEMBL3714170 | 0.74 | — | — | |
| SCHEMBL343241 | 0.73 | — | — | |
| SCHEMBL342913 | 0.72 | — | — | |
| SCHEMBL476746 | 0.70 | — | — | |
| SCHEMBL344587 | 0.67 | NR1H2 (0.34) | — | |
| SCHEMBL921841 | 0.65 | PPM1D (0.31) | — | |
| SCHEMBL25307217 | 0.64 | — | — | |
| SCHEMBL343240 | 0.63 | NR1H2 (0.33) | — | |
| SCHEMBL26096030 | 0.62 | — | — |
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-2411012-A1 | NOVEL AMINOPYRIDINE DERIVATIVES HAVING AURORA A SELECTIVE INHIBITORY ACTION | MSD K.K. (JP) | 2012-02-01 | — | — | EP | disclosed |
| US-20120015940-A1 | NOVEL AMINOPYRIDINE DERIVATIVES HAVING AURORA A SELECTIVE INHIBITORY ACTION | BANYU PHARMACEUTICALS CO., LTD. (JP) | 2012-01-19 | — | — | US | disclosed |