⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8252953 | 0.82 | — | — | |
| SCHEMBL8266336 | 0.78 | — | — | |
| SCHEMBL5987704 | 0.78 | — | — | |
| SCHEMBL17835218 | 0.76 | — | — | |
| SCHEMBL10062257 | 0.75 | — | — | |
| SCHEMBL12390851 | 0.67 | — | — | |
| SCHEMBL866572 | 0.66 | — | — | |
| SCHEMBL15305253 | 0.65 | PIM1 (0.32) | — | |
| SCHEMBL17446895 | 0.64 | — | — | |
| SCHEMBL867563 | 0.64 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024033280-A1 | FUROPYRIDIN AND FUROPYRIMIDIN, INHIBITORS OF PI4K, FOR USE IN THE TREATMENT OF PARASITE INFECTION AND MALARIA | MERCK PATENT GMBH (DE) | 2024-02-15 | — | — | WO | disclosed |