⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27656785 | 0.87 | — | — | |
| SCHEMBL28237693 | 0.82 | — | — | |
| SCHEMBL28307795 | 0.82 | — | — | |
| SCHEMBL1645015 | 0.82 | — | — | |
| SCHEMBL2351926 | 0.82 | — | — | |
| SCHEMBL28201979 | 0.78 | — | — | |
| SCHEMBL11867808 | 0.67 | — | — | |
| Water SCHEMBL9193210 | 0.67 | — | — | |
| SCHEMBL9189597 | 0.67 | — | — | |
| Fluoride SCHEMBL7101711 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106064945-A | PZT base piezoelectric ceramic of calcium lithium ytterbium codope and preparation method thereof | 四川大学 | 2016-11-02 | — | — | CN | claimed |
| CN-106064945-A | PZT base piezoelectric ceramic of calcium lithium ytterbium codope and preparation method thereof | 四川大学 | 2016-11-02 | — | — | CN | disclosed |
| CN-106064945-A | PZT base piezoelectric ceramic of calcium lithium ytterbium codope and preparation method thereof | 四川大学 | 2016-11-02 | — | — | CN | disclosed |