⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21249120 | 0.71 | — | — | |
| SCHEMBL24724919 | 0.71 | CA12 (0.31) | — | |
| SCHEMBL30590029 | 0.67 | — | — | |
| SCHEMBL11472567 | 0.67 | — | — | |
| SCHEMBL16062249 | 0.67 | CA1 (0.34) | — | |
| SCHEMBL22640978 | 0.64 | GAA (0.36) | — | |
| SCHEMBL21683322 | 0.63 | — | — | |
| SCHEMBL25266903 | 0.62 | CA1 (0.32) | — | |
| SCHEMBL24256219 | 0.62 | — | — | |
| SCHEMBL23181267 | 0.62 | PDE4D (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3145934-B1 | SUBSTITUTED-6,8-DIOXABICYCLO[3.2.1]OCTANE-2,3-DIOL COMPOUNDS AS TARGETING AGENTS OF ASGPR | PFIZER (US) | 2020-11-11 | — | — | EP | disclosed |