⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4350923 | 0.77 | — | — | |
| SCHEMBL23723679 | 0.68 | — | — | |
| SCHEMBL6212661 | 0.68 | — | — | |
| SCHEMBL4361618 | 0.67 | — | — | |
| SCHEMBL22339498 | 0.67 | — | — | |
| SCHEMBL22322726 | 0.64 | — | — | |
| SCHEMBL21737679 | 0.64 | — | — | |
| SCHEMBL2425281 | 0.61 | CYP2C9 (0.34) | — | |
| SCHEMBL2549734 | 0.61 | ADORA2A (0.41) | — | |
| SCHEMBL22340054 | 0.60 | DYRK1A (0.33) | — |
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-1556349-A1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS | Astrazeneca AB (SE) | 2005-07-27 | — | — | EP | disclosed |
| WO-2004033427-A1 | 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS | ASTRAZENECA AB (SE) | 2004-04-22 | — | — | WO | disclosed |