⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12925939 | 0.76 | LMNA (0.34) | — | |
| SCHEMBL31555357 | 0.73 | KDM5B (0.31) | — | |
| SCHEMBL26700245 | 0.73 | KDM5B (0.31) | — | |
| SCHEMBL22681423 | 0.71 | — | — | |
| SCHEMBL21542786 | 0.71 | ALDH1A1 (0.30) | — | |
| SCHEMBL17973799 | 0.71 | GCGR (0.32) | — | |
| SCHEMBL24070513 | 0.69 | — | — | |
| SCHEMBL10376639 | 0.69 | LMNA (0.50) | — | |
| SCHEMBL21543146 | 0.67 | NOS3 (0.33) | — | |
| SCHEMBL24832731 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9216173-B2 | 2-Pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors | MERCK SHARP & DOHME CORP. (US) | 2015-12-22 | — | — | US | disclosed |
| US-20140243336-A1 | 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors | MERCK SHARP & DOHME LLC | 2014-08-28 | — | — | US | disclosed |