⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL671335 | 0.84 | — | — | |
| SCHEMBL2627461 | 0.80 | — | — | |
| SCHEMBL18500517 | 0.77 | ACHE (0.30) | — | |
| SCHEMBL25014161 | 0.72 | — | — | |
| SCHEMBL3696791 | 0.70 | — | — | |
| SCHEMBL3947692 | 0.70 | — | — | |
| SCHEMBL5933734 | 0.70 | — | — | |
| SCHEMBL18705424 | 0.69 | — | — | |
| SCHEMBL24667544 | 0.69 | — | — | |
| SCHEMBL24445527 | 0.69 | CYP1A2 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114832119-B | Radioactive gel microsphere and preparation method and application thereof | 苏州大学 | 2024-02-09 | — | — | CN | disclosed |
| CN-114106941-A | Self-lubricating concentrated laundry detergent product and preparation method thereof | 广东优凯科技有限公司 | 2022-03-01 | — | — | CN | disclosed |
| CN-103896825-B | A kind of 9,10-diarylethene base anthracene aggregation-induced emission molecule and preparation method thereof | SOUTHEAST UNIVERSITY (CN) | 2015-11-11 | — | — | CN | disclosed |
| CN-103524404-B | Pyridine-triphenylamine-anthracene conjugated molecule with aggregation-induced emission property and preparation method thereof | UNIV SOUTHEAST | 2015-03-18 | — | — | CN | disclosed |