⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22098670 | 1.00 | — | — | |
| SCHEMBL16212915 | 0.81 | — | — | |
| SCHEMBL2440303 | 0.76 | — | — | |
| SCHEMBL17673470 | 0.76 | — | — | |
| SCHEMBL6448459 | 0.76 | — | — | |
| SCHEMBL965093 | 0.76 | — | — | |
| SCHEMBL6133008 | 0.73 | — | — | |
| SCHEMBL10223489 | 0.69 | — | — | |
| SCHEMBL22034671 | 0.68 | — | — | |
| SCHEMBL22034584 | 0.68 | — | — |
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-1226126-B1 | PYRIMIDINE DERIVATIVES | ASTRAZENECA AB (SE) | 2005-01-05 | — | — | EP | claimed |