⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28526985 | 0.65 | — | — | |
| SCHEMBL11227053 | 0.62 | — | — | |
| SCHEMBL9403423 | 0.54 | — | — | |
| SCHEMBL13286825 | 0.53 | — | — | |
| SCHEMBL27645520 | 0.53 | — | — | |
| SCHEMBL18726685 | 0.52 | NOS3 (0.34) | — | |
| SCHEMBL31679699 | 0.52 | — | — | |
| SCHEMBL13286809 | 0.51 | MAPT (0.34) | — | |
| SCHEMBL17149307 | 0.50 | — | — | |
| SCHEMBL17581100 | 0.50 | — | — |
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-112490510-A | Button battery and preparation method thereof | 广东微电新能源有限公司 | 2021-03-12 | — | — | CN | disclosed |