⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8092613 | 0.95 | — | — | |
| SCHEMBL8063806 | 0.78 | SLC34A1 (0.30) | — | |
| SCHEMBL3194101 | 0.72 | — | — | |
| Water SCHEMBL16322765 | 0.69 | SLC34A1 (0.35) | — | |
| Potassium Ion SCHEMBL9644009 | 0.68 | SLC34A1 (0.38) | — | |
| SCHEMBL9543672 | 0.68 | LMNA (0.32) | — | |
| SCHEMBL9539968 | 0.65 | LAP3 (0.38) | — | |
| SCHEMBL7755496 | 0.65 | SLC34A1 (0.31) | — | |
| Peroxymonophosphate SCHEMBL150288 | 0.65 | LMNA (0.41) | — | |
| SCHEMBL7549084 | 0.64 | CTSA (0.30) | — |
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-0405084-A2 | Additive for cement mortar and/or concrete | LION CORPORATION (JP) | 1991-01-02 | — | — | EP | disclosed |