⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL792423 | 1.00 | — | — | |
| SCHEMBL7930805 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL12082127 | 0.81 | NPC1 (0.43) | — | |
| SCHEMBL5581818 | 0.79 | — | — | |
| SCHEMBL5581821 | 0.79 | — | — | |
| SCHEMBL7318522 | 0.79 | — | — | |
| SCHEMBL12663476 | 0.78 | LMNA (0.32) | — | |
| SCHEMBL6703394 | 0.77 | — | — | |
| SCHEMBL13406583 | 0.77 | LMNA (0.40) | — | |
| SCHEMBL18542659 | 0.77 | — | — |
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-1575958-A1 | FUNGICIDAL TRIAZOLOPYRIMIDINES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF FOR CONTROLLING HARMFUL FUNGI, AND AGENTS CONTAINING SAID FUNGICIDAL TRIAZOLOPYRIMIDINES | BASF AKTIENGESELLSCHAFT (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004055018-A1 | FUNGICIDAL TRIAZOLOPYRIMIDINES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF FOR CONTROLLING HARMFUL FUNGI, AND AGENTS CONTAINING SAID FUNGICIDAL TRIAZOLOPYRIMIDINES | BASF AKTIENGESELLSCHAFT (DE) | 2004-07-01 | — | — | WO | disclosed |