⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8558751 | 1.00 | — | — | |
| SCHEMBL8556416 | 0.85 | — | — | |
| SCHEMBL8555174 | 0.74 | PDK2 (0.31) | — | |
| SCHEMBL8559658 | 0.74 | — | — | |
| SCHEMBL8560875 | 0.68 | MEN1 (0.36) | — | |
| SCHEMBL9096154 | 0.67 | ADRB2 (0.31) | — | |
| SCHEMBL9096150 | 0.67 | ADRB2 (0.31) | — | |
| SCHEMBL8559665 | 0.66 | PDK2 (0.33) | — | |
| SCHEMBL8559228 | 0.65 | PDK2 (0.34) | — | |
| SCHEMBL9095249 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0653426-B1 | Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same | KOWA CO (JP) | 1998-07-22 | — | — | EP | disclosed |
| US-5510366-A | INOTROPIC, ANTIARRHYMTHMIA AGENTS, VASODILATORS | KOWA CO., LTD. (JP) | 1996-04-23 | — | — | US | disclosed |
| EP-0653426-A1 | Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same | KOWA COMPANY, LTD. (JP) | 1995-05-17 | — | — | EP | disclosed |