⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27970673 | 0.93 | KMT2A (0.33) | — | |
| SCHEMBL28061261 | 0.93 | KMT2A (0.33) | — | |
| SCHEMBL28016232 | 0.91 | MEN1 (0.32) | — | |
| Bromide SCHEMBL28825975 | 0.89 | SNCA (0.33) | — | |
| SCHEMBL28295478 | 0.84 | — | — | |
| Zinc Ion SCHEMBL28819502 | 0.81 | CES2 (0.34) | — | |
| Terephthalic Acid SCHEMBL28067237 | 0.81 | TSHR (0.45) | — | |
| Acetic Acid SCHEMBL28062766 | 0.80 | CA2 (0.36) | — | |
| SCHEMBL28074476 | 0.78 | — | — | |
| SCHEMBL27916776 | 0.78 | MEN1 (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105524080-A | Potential fluorescent material tetraphenyl ethylene tetra-triazole copper chloride complex and preparation method thereof | UNIV TIANJIN | 2016-04-27 | — | — | CN | disclosed |
| CN-105524080-A | Potential fluorescent material tetraphenyl ethylene tetra-triazole copper chloride complex and preparation method thereof | UNIV TIANJIN | 2016-04-27 | — | — | CN | disclosed |