⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27497716 | 0.73 | — | — | |
| SCHEMBL9502074 | 0.73 | — | — | |
| SCHEMBL1407016 | 0.69 | — | — | |
| SCHEMBL28157619 | 0.66 | PRKCA (0.32) | — | |
| SCHEMBL134403 | 0.61 | TSHR (0.41) | — | |
| SCHEMBL9764248 | 0.60 | — | — | |
| SCHEMBL12496409 | 0.60 | — | — | |
| SCHEMBL8621409 | 0.59 | TSHR (0.43) | — | |
| SCHEMBL22109759 | 0.59 | TSHR (0.43) | — | |
| SCHEMBL8625736 | 0.57 | TSHR (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110407866-A | The manufacturing method of silicon compound | LANXI LISHUN BIOLOGY CO LTD | 2019-11-05 | — | — | CN | disclosed |