⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4191945 | 0.82 | — | — | |
| SCHEMBL240621 | 0.59 | — | — | |
| SCHEMBL486074 | 0.59 | — | — | |
| SCHEMBL6887065 | 0.59 | — | — | |
| SCHEMBL2473867 | 0.55 | NOS2 (0.35) | — | |
| SCHEMBL10067 | 0.55 | — | — | |
| SCHEMBL31673148 | 0.55 | — | — | |
| SCHEMBL27511 | 0.55 | — | — | |
| SCHEMBL16316615 | 0.55 | — | — | |
| SCHEMBL1032379 | 0.55 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090149455-A1 | Use of Triazolopyrimidines for Controlling Plant Diseases on Legumes | BAYER CROPSCIENCE AG (DE) | 2009-06-11 | — | — | US | disclosed |
| EP-1915155-A1 | DIHYDROPTERIDINONES IN THE TREATMENT OF RESPIRATORY DISEASES | Boehringer Ingelheim International GmbH (DE) | 2008-04-30 | — | — | EP | disclosed |
| WO-2007014838-A1 | DIHYDROPTERIDINONES IN THE TREATMENT OF RESPIRATORY DISEASES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-02-08 | — | — | WO | disclosed |
| US-20050234076-A1 | Triazolopyrimidines | BAYER CROPSCIENCE AG (DE) | 2005-10-20 | — | — | US | disclosed |