⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2374264 | 0.71 | — | — | |
| SCHEMBL19096 | 0.71 | — | — | |
| SCHEMBL180757 | 0.61 | — | — | |
| SCHEMBL11569584 | 0.61 | — | — | |
| SCHEMBL5897645 | 0.55 | — | — | |
| SCHEMBL7056855 | 0.55 | — | — | |
| SCHEMBL7615128 | 0.55 | — | — | |
| SCHEMBL4301414 | 0.55 | — | — | |
| SCHEMBL11659799 | 0.55 | — | — | |
| SCHEMBL14151417 | 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 |
|---|---|---|---|---|---|---|---|
| CN-106317056-A | Pyrazolopyridine derivatives, preparation process therefor and therapeutic use thereof | 赛诺菲 | 2017-01-11 | — | — | CN | disclosed |
| CN-104114555-A | Pyrazolopyrimidine derivatives, process for their preparation and their therapeutic use | SANOFI SA | 2014-10-22 | — | — | CN | disclosed |
| US-20140018377-A1 | Aminopropenoates as Fungicides | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-01-16 | — | — | US | disclosed |
| US-20030224943-A1 | Novel tetrazole derivatives | BAYER CROPSCIENCE K. K. (JP) | 2003-12-04 | — | — | US | disclosed |