⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL391539 | 0.79 | — | — | |
| SCHEMBL28289924 | 0.77 | — | — | |
| SCHEMBL3526133 | 0.67 | — | — | |
| SCHEMBL27616723 | 0.67 | — | — | |
| SCHEMBL3716136 | 0.67 | — | — | |
| SCHEMBL28272287 | 0.66 | ADH1B (0.43) | — | |
| SCHEMBL402375 | 0.64 | — | — | |
| SCHEMBL27871756 | 0.64 | — | — | |
| SCHEMBL28242127 | 0.64 | — | — | |
| SCHEMBL22545294 | 0.64 | ADH1B (0.41) | — |
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-105517993-B | Aryl amide kinase inhibitors | 百时美施贵宝公司 | 2018-07-13 | — | — | CN | disclosed |
| WO-2010134082-A1 | CHROMENONE DERIVATIVES FOR TREATMENT OF CANCER | PROTEOLOGICS LTD (IL) | 2010-11-25 | — | — | WO | disclosed |