⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2067166 | 0.77 | IMPDH2 (0.36) | — | |
| SCHEMBL2067217 | 0.77 | XDH (0.37) | — | |
| SCHEMBL3516652 | 0.72 | — | — | |
| SCHEMBL8076152 | 0.69 | BCL2 (0.33) | — | |
| SCHEMBL7190874 | 0.67 | ALDH1A1 (0.31) | — | |
| SCHEMBL2067168 | 0.65 | IMPDH2 (0.33) | — | |
| SCHEMBL2067220 | 0.65 | GABRA1 (0.40) | — | |
| SCHEMBL299910 | 0.64 | — | — | |
| SCHEMBL2067857 | 0.62 | KDM4E (0.33) | — | |
| SCHEMBL3649976 | 0.61 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1832586-A1 | Thiazole-piperidine derivatives in treatment of diseases of liver and the pancreas | Oridis Biomed Forschungs- und Entwicklungs GmbH (AT) | 2007-09-12 | — | — | EP | claimed |
| EP-1832586-A1 | Thiazole-piperidine derivatives in treatment of diseases of liver and the pancreas | Oridis Biomed Forschungs- und Entwicklungs GmbH (AT) | 2007-09-12 | — | — | EP | disclosed |