⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30308379 | 0.64 | — | — | |
| SCHEMBL9391841 | 0.60 | — | — | |
| SCHEMBL28510815 | 0.60 | — | — | |
| SCHEMBL11455703 | 0.60 | — | — | |
| SCHEMBL9984732 | 0.59 | — | — | |
| SCHEMBL6692309 | 0.56 | CA1 (0.32) | — | |
| SCHEMBL1598764 | 0.56 | — | — | |
| SCHEMBL1598986 | 0.55 | — | — | |
| SCHEMBL7641733 | 0.55 | ALDH1A1 (0.38) | — | |
| SCHEMBL4616133 | 0.53 | KMT2A (0.49) | — |
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-116390603-A | Method for improving perovskite battery performance by quantum dots | 内蒙古鄂尔多斯电力冶金集团股份有限公司 | 2023-07-04 | — | — | CN | disclosed |