⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4968672 | 0.72 | MAP4K4 (0.49) | — | |
| SCHEMBL16417590 | 0.70 | DYRK1A (0.35) | — | |
| SCHEMBL4968697 | 0.67 | MAPT (0.33) | — | |
| SCHEMBL26123156 | 0.66 | ALDH1A1 (0.33) | — | |
| SCHEMBL4968409 | 0.64 | MAPT (0.33) | — | |
| SCHEMBL4970795 | 0.64 | KMT2A (0.34) | — | |
| SCHEMBL4968423 | 0.64 | NPC1 (0.33) | — | |
| SCHEMBL21672739 | 0.63 | DYRK1A (0.40) | — | |
| SCHEMBL2779348 | 0.62 | P2RX7 (0.40) | — | |
| SCHEMBL377165 | 0.62 | KDM4E (0.44) | — |
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-1778685-B1 | INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF | SANOL ARZNEI SCHWARZ GMBH (DE) | 2008-03-26 | — | — | EP | disclosed |
| EP-1778685-A1 | INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF | SCHWARZ PHARMA AG (DE) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006015737-A1 | INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF | SCHWARZ PHARMA AG (DE) | 2006-02-16 | — | — | WO | disclosed |