⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8529454 | 0.94 | — | — | |
| SCHEMBL11356945 | 0.94 | — | — | |
| SCHEMBL8503530 | 0.94 | — | — | |
| SCHEMBL17262 | 0.94 | — | — | |
| SCHEMBL8558807 | 0.88 | — | — | |
| SCHEMBL913498 | 0.88 | — | — | |
| Potassium Ion SCHEMBL3889656 | 0.88 | — | — | |
| SCHEMBL1370871 | 0.88 | — | — | |
| SCHEMBL355458 | 0.88 | — | — | |
| SCHEMBL222659 | 0.88 | — | — |
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-6626243-B1 | Methods and compositions for use in cementing in cold environments | BJ SERVICES COMPANY | 2003-09-30 | — | — | US | disclosed |