⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19861044 | 1.00 | — | — | |
| SCHEMBL16920175 | 0.92 | — | — | |
| SCHEMBL19860997 | 0.92 | — | — | |
| SCHEMBL16920130 | 0.92 | PIK3C2B (0.31) | — | |
| SCHEMBL19861014 | 0.92 | PIK3C2B (0.31) | — | |
| SCHEMBL16920133 | 0.91 | PIK3C2B (0.31) | — | |
| SCHEMBL16920157 | 0.91 | — | — | |
| SCHEMBL19861043 | 0.91 | — | — | |
| SCHEMBL19861048 | 0.90 | PIK3C2B (0.30) | — | |
| SCHEMBL17399669 | 0.90 | PIK3C2B (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180141906-A1 | INDOLE AND AZAINDOLE DERIVATIVE HAVING AMPK-ACTIVATING ACTIVITY | SHIONOGI & CO. , LTD. (JP) | 2018-05-24 | — | — | US | disclosed |
| US-9890119-B2 | Indole and azaindole derivative having AMPK-activating activity | SHIONOGI & CO., LTD. (JP) | 2018-02-13 | — | — | US | disclosed |
| EP-2963013-A1 | INDOLE AND AZAINDOLE DERIVATIVES EACH HAVING AMPK-ACTIVATING ACTIVITY | Shionogi & Co., Ltd. (JP) | 2016-01-06 | — | — | EP | disclosed |
| US-20150203450-A1 | INDOLE AND AZAINDOLE DERIVATIVE HAVING AMPK-ACTIVATING ACTIVITY | SHIONOGI & CO., LTD. (JP) | 2015-07-23 | — | — | US | disclosed |