⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4065847 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL4073430 | 0.88 | — | — | |
| SCHEMBL402489 | 0.87 | — | — | |
| SCHEMBL4067705 | 0.86 | — | — | |
| SCHEMBL4069102 | 0.81 | MEN1 (0.37) | — | |
| SCHEMBL399767 | 0.78 | — | — | |
| SCHEMBL399693 | 0.78 | KDM4E (0.35) | — | |
| SCHEMBL4074225 | 0.77 | — | — | |
| SCHEMBL399309 | 0.77 | IGF1R (0.32) | — | |
| SCHEMBL4063195 | 0.76 | — | — |
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-1740591-B1 | 6,6-BICYCLIC RING SUBSTITUTED HETEROBICYCLIC PROTEIN KINASE INHIBITORS | OSI PHARM INC (US) | 2009-06-17 | — | — | EP | claimed |