⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8769503 | 0.69 | — | — | |
| SCHEMBL2137186 | 0.67 | — | — | |
| SCHEMBL537449 | 0.67 | — | — | |
| SCHEMBL2020103 | 0.67 | — | — | |
| SCHEMBL2136788 | 0.65 | — | — | |
| SCHEMBL13990157 | 0.65 | — | — | |
| SCHEMBL4653973 | 0.65 | — | — | |
| Hydrogen Sulfide SCHEMBL2511821 | 0.63 | — | — | |
| SCHEMBL538315 | 0.63 | — | — | |
| SCHEMBL30294142 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1828211-A1 | NOVEL TRIAZOLOPYRIMIDINE DERIVATIVES | Syngeta Participations AG (CH) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006066872-A1 | NOVEL TRIAZOLOPYRIMIDINE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2006-06-29 | — | — | WO | disclosed |