⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5670596 | 0.79 | GRM2 (0.39) | — | |
| SCHEMBL1687665 | 0.79 | LIPA (0.31) | — | |
| SCHEMBL27048536 | 0.73 | — | — | |
| SCHEMBL12898096 | 0.72 | THRA (0.31) | — | |
| SCHEMBL24113782 | 0.72 | THRA (0.31) | — | |
| SCHEMBL13202376 | 0.72 | THRA (0.35) | — | |
| SCHEMBL6712410 | 0.72 | THRA (0.35) | — | |
| SCHEMBL5670060 | 0.70 | LIPA (0.32) | — | |
| SCHEMBL9313545 | 0.68 | — | — | |
| SCHEMBL9205192 | 0.68 | THRA (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1401399-A2 | PHARMACEUTICAL COMPOSITIONS CONTAINING POLYMER AND DRUG ASSEMBLIES | Pfizer Products Inc. (US) | 2004-03-31 | — | — | EP | disclosed |
| WO-2003000226-A2 | PHARMACEUTICAL COMPOSITIONS CONTAINING POLYMER AND DRUG ASSEMBLIES | PFIZER PRODUCTS INC. (US) | 2003-01-03 | — | — | WO | disclosed |