⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2428603 | 0.69 | — | — | |
| SCHEMBL8279802 | 0.63 | — | — | |
| SCHEMBL12520988 | 0.61 | — | — | |
| SCHEMBL4670254 | 0.59 | NPSR1 (0.37) | — | |
| SCHEMBL3466146 | 0.59 | — | — | |
| SCHEMBL3466593 | 0.59 | — | — | |
| SCHEMBL14685353 | 0.59 | — | — | |
| SCHEMBL2634616 | 0.56 | — | — | |
| SCHEMBL1668386 | 0.54 | — | — | |
| SCHEMBL4641826 | 0.49 | — | — |
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-2000140-A1 | Use of derivatives of 3-oxo-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine or of 3-oxo-2,3-dihydro-5H-imidazolo[3,2-a]pyrimidine for the preparation of pharmaceutical compositions intended for the treatment of cancer | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2008-12-10 | — | — | EP | disclosed |