⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3561677 | 0.97 | — | — | |
| SCHEMBL6233224 | 0.97 | — | — | |
| SCHEMBL3571508 | 0.91 | — | — | |
| SCHEMBL662994 | 0.87 | — | — | |
| SCHEMBL8423128 | 0.84 | TSHR (0.30) | — | |
| SCHEMBL517125 | 0.84 | TSHR (0.30) | — | |
| SCHEMBL3562167 | 0.78 | — | — | |
| SCHEMBL8610530 | 0.74 | TSHR (0.48) | — | |
| SCHEMBL6066342 | 0.74 | — | — | |
| SCHEMBL2569586 | 0.74 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1852420-B1 | Indole compounds for treating respiratory disorders | ONO PHARMACEUTICAL CO (JP) | 2012-10-17 | — | — | EP | disclosed |
| US-7728023-B2 | Indole compound and use thereof | ONO PHARMACEUTICAL CO., LTD. (JP) | 2010-06-01 | — | — | US | disclosed |
| US-20080188532-A1 | Indole Compound and Use Thereof | ONO PHARMACEUTICAL CO., LTD. (JP) | 2008-08-07 | — | — | US | disclosed |
| EP-1852420-A1 | INDOLE COMPOUND AND USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-11-07 | — | — | EP | disclosed |
| US-5916474-A | BLOCK POLYMER OF CAPROLACTAM AND ALKYLENE OXIDE WITH ALKYLENE OXIDE UNIT CAPPED WITH ALKANOL FATTY AMINE OR AMIDE | TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) | 1999-06-29 | — | — | US | disclosed |
| EP-0425925-A2 | Substituted amino acid amide derivatives, their preparation and use | BAYER AG (DE) | 1991-05-08 | — | — | EP | disclosed |