⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6542208 | 0.64 | — | — | |
| SCHEMBL24061434 | 0.60 | — | — | |
| SCHEMBL30104142 | 0.58 | — | — | |
| SCHEMBL9379076 | 0.58 | — | — | |
| SCHEMBL57080 | 0.57 | — | — | |
| SCHEMBL6678004 | 0.56 | — | — | |
| SCHEMBL30708579 | 0.56 | — | — | |
| SCHEMBL26512104 | 0.56 | MAPKAPK2 (0.35) | — | |
| SCHEMBL5760552 | 0.55 | MEN1 (0.36) | — | |
| SCHEMBL8900194 | 0.53 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040224951-A1 | 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors | ROARK WILLIAM HOWARD (US) | 2004-11-11 | — | — | US | disclosed |
| US-20040063673-A1 | Cyclic compounds containing zinc binding groups as matrix metalloproteinase inhibitors | JOHNSON ADAM RICHARD (US) | 2004-04-01 | — | — | US | disclosed |
| EP-0327284-B1 | Triazolo(1,5-c)pyrimido(1,4) azines as bronchodilators | RIKER LABORATORIES INC (US) | 1994-08-17 | — | — | EP | disclosed |
| US-5166343-A | Chemical intermediates for bronchodilators | RIKER LABORATORIES, INC. (US) | 1992-11-24 | — | — | US | disclosed |
| US-5089493-A | Triazolo[1,5-C]pyrimido[1,4]azines as bronchodilators | RIKER LABORATORIES, INC. (US) | 1992-02-18 | — | — | US | disclosed |
| US-4981850-A | Triazolo[1,5-c]pyrimido[1,4]azines as bronchodilators | RIKER LABORATORIES, INC. (US) | 1991-01-01 | — | — | US | disclosed |
| EP-0327284-A2 | Triazolo(1,5-c)pyrimido(1,4) azines as bronchodilators | RIKER LABORATORIES, INC. (US) | 1989-08-09 | — | — | EP | disclosed |