⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14957088 | 0.78 | — | — | |
| SCHEMBL17239042 | 0.74 | — | — | |
| SCHEMBL3481525 | 0.74 | — | — | |
| SCHEMBL13089506 | 0.73 | — | — | |
| SCHEMBL1617909 | 0.72 | — | — | |
| SCHEMBL3481962 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL7190640 | 0.70 | — | — | |
| SCHEMBL13089579 | 0.70 | — | — | |
| Ether SCHEMBL28272266 | 0.69 | — | — | |
| SCHEMBL9654054 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111989348-A | Polymer having reactive silicon-containing group and method for producing same | 信越化学工业株式会社 | 2020-11-24 | — | — | CN | disclosed |