⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8890214 | 1.00 | — | — | |
| SCHEMBL6205007 | 0.75 | — | — | |
| SCHEMBL9089960 | 0.72 | — | — | |
| SCHEMBL9282299 | 0.70 | — | — | |
| SCHEMBL12263601 | 0.67 | — | — | |
| SCHEMBL28704630 | 0.66 | DUSP22 (0.30) | — | |
| SCHEMBL28665694 | 0.66 | DUSP22 (0.30) | — | |
| SCHEMBL28660040 | 0.64 | — | — | |
| SCHEMBL9805768 | 0.62 | — | — | |
| SCHEMBL28246263 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5602277-A | Substituted benzene derivatives useful as neuraminidase inhibitors | BIOCRYST PHARMACEUTICALS, INC. (US) | 1997-02-11 | — | — | US | disclosed |
| WO-1996030329-A1 | SUBSTITUTED BENZENE DERIVATIVES USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INCORPORATED (US) | 1996-10-03 | — | — | WO | disclosed |