⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6061285 | 0.82 | — | — | |
| SCHEMBL28676333 | 0.69 | ACHE (0.31) | — | |
| SCHEMBL527137 | 0.69 | — | — | |
| SCHEMBL261906 | 0.69 | MEN1 (0.31) | — | |
| SCHEMBL28680128 | 0.68 | — | — | |
| SCHEMBL26129174 | 0.68 | — | — | |
| SCHEMBL4420108 | 0.68 | MAPT (0.34) | — | |
| SCHEMBL3495824 | 0.67 | — | — | |
| SCHEMBL1219806 | 0.65 | — | — | |
| SCHEMBL19225955 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107298638-A | A kind of process for catalytic synthesis of the dione compounds of dihydroindene 1,3 | 申清章 | 2017-10-27 | — | — | CN | disclosed |
| CN-106977385-A | A kind of process for catalytic synthesis of the dione compounds of dihydroindene 1,3 | 申清章 | 2017-07-25 | — | — | CN | disclosed |
| CN-106916057-A | The process for catalytic synthesis of the dione compounds of dihydroindene 1,3 | 申清章 | 2017-07-04 | — | — | CN | disclosed |
| CN-106905123-A | The process for catalytic synthesis of the dione compounds of dihydroindene 1,3 | 申清章 | 2017-06-30 | — | — | CN | disclosed |
| CN-105294412-B | Catalytic synthesis method of indan-1, 3-dione compound | 南陵县生产力促进中心有限公司 | 2017-03-22 | — | — | CN | disclosed |