⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3182780 | 1.00 | — | — | |
| SCHEMBL10049921 | 0.77 | THRB (0.35) | — | |
| SCHEMBL5704678 | 0.76 | — | — | |
| SCHEMBL5043755 | 0.76 | — | — | |
| SCHEMBL5704709 | 0.76 | — | — | |
| SCHEMBL8560919 | 0.74 | — | — | |
| SCHEMBL9968791 | 0.74 | THRB (0.33) | — | |
| SCHEMBL5915250 | 0.74 | — | — | |
| SCHEMBL1760702 | 0.74 | — | — | |
| SCHEMBL799189 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20020166629-A1 | Contact metathesis polymerization | LORD CORPORATION | 2002-11-14 | — | — | US | disclosed |