⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3439112 | 0.78 | — | — | |
| SCHEMBL3439209 | 0.78 | — | — | |
| SCHEMBL2223466 | 0.78 | — | — | |
| SCHEMBL4587915 | 0.77 | — | — | |
| SCHEMBL15120303 | 0.76 | — | — | |
| SCHEMBL10055890 | 0.75 | BCAT2 (0.41) | — | |
| SCHEMBL10055927 | 0.73 | — | — | |
| SCHEMBL1315186 | 0.73 | — | — | |
| SCHEMBL10056070 | 0.73 | — | — | |
| SCHEMBL7935567 | 0.73 | BCAT2 (0.39) | — |
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-2802576-B1 | HETEROCYCLIC-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-06-27 | — | — | EP | disclosed |