⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8923078 | 0.84 | — | — | |
| SCHEMBL9384890 | 0.82 | — | — | |
| SCHEMBL9384877 | 0.82 | — | — | |
| SCHEMBL8924987 | 0.81 | — | — | |
| SCHEMBL8924989 | 0.81 | — | — | |
| SCHEMBL8921557 | 0.80 | — | — | |
| SCHEMBL8921566 | 0.80 | — | — | |
| SCHEMBL8922015 | 0.79 | — | — | |
| SCHEMBL9272371 | 0.79 | — | — | |
| SCHEMBL9385366 | 0.79 | — | — |
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-5618928-A | USEFUL IN TREATMENT OF PNEUMOCYSTIS CARINII INFECTIONS | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1997-04-08 | — | — | US | disclosed |
| WO-1994002469-A1 | PYRIMIDINE COMPOUNDS USED IN THE THERAPY | BRITISH TECHNOLOGY GROUP LTD. (GB) | 1994-02-03 | — | — | WO | disclosed |