⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL775845 | 0.75 | CA1 (0.37) | — | |
| SCHEMBL19112362 | 0.73 | CA1 (0.31) | — | |
| SCHEMBL11897837 | 0.71 | — | — | |
| SCHEMBL776230 | 0.71 | CA1 (0.33) | — | |
| SCHEMBL25501337 | 0.71 | — | — | |
| SCHEMBL776343 | 0.71 | — | — | |
| SCHEMBL17744 | 0.69 | — | — | |
| Fluoride SCHEMBL776344 | 0.69 | — | — | |
| SCHEMBL777742 | 0.67 | CA1 (0.35) | — | |
| SCHEMBL776788 | 0.67 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2611802-B1 | BICYCLIC AZA-HETEROCYCLES AND THEIR USE | BAYER IP GMBH (DE) | 2016-02-24 | — | — | EP | disclosed |
| US-9150580-B2 | Substituted imidazopyridines and the use thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-10-06 | — | — | US | disclosed |
| US-9150580-B2 | Substituted imidazopyridines and the use thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-10-06 | — | — | US | disclosed |
| US-9096592-B2 | Bicyclic aza heterocycles, and use thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-08-04 | — | — | US | disclosed |
| US-20140148433-A1 | BICYCLIC AZA HETEROCYCLES, AND USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-05-29 | — | — | US | disclosed |
| US-20140148433-A1 | BICYCLIC AZA HETEROCYCLES, AND USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-05-29 | — | — | US | disclosed |
| US-20140113900-A1 | SUBSTITUTED IMIDAZOPYRIDINES AND THE USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-04-24 | — | — | US | disclosed |
| US-20140113900-A1 | SUBSTITUTED IMIDAZOPYRIDINES AND THE USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-04-24 | — | — | US | disclosed |
| WO-2012028647-A1 | BICYCLIC AZA HETEROCYCLES, AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-03-08 | — | — | WO | disclosed |