⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4235899 | 0.74 | MEN1 (0.30) | — | |
| SCHEMBL1673128 | 0.72 | — | — | |
| SCHEMBL1857660 | 0.72 | IDO1 (0.53) | — | |
| SCHEMBL5265611 | 0.72 | — | — | |
| SCHEMBL20641805 | 0.72 | — | — | |
| SCHEMBL29973049 | 0.71 | DHFR (0.42) | — | |
| SCHEMBL6003619 | 0.70 | KDR (0.38) | — | |
| SCHEMBL29267665 | 0.70 | CDK5 (0.40) | — | |
| SCHEMBL1924499 | 0.69 | KDM4E (0.48) | — | |
| SCHEMBL5236188 | 0.69 | IDO1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101155800-B | Pyrazolylaminopyridine derivatives useful as kinase inhibitors | ASTRAZENECA AB | 2012-05-23 | — | — | CN | disclosed |
| CN-101155800-A | Pyrazolylaminopyridine derivatives useful as kinase inhibitors | ASTRAZENECA AB (SE) | 2008-04-02 | — | — | CN | disclosed |