⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18630376 | 0.78 | — | — | |
| SCHEMBL14155626 | 0.72 | — | — | |
| SCHEMBL4319418 | 0.69 | — | — | |
| SCHEMBL19988107 | 0.69 | — | — | |
| SCHEMBL8717437 | 0.65 | — | — | |
| SCHEMBL28847088 | 0.60 | — | — | |
| SCHEMBL21415913 | 0.60 | — | — | |
| SCHEMBL12518837 | 0.59 | — | — | |
| SCHEMBL12518838 | 0.59 | — | — | |
| SCHEMBL7959830 | 0.59 | PLAU (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2222664-B1 | CYCLOALKYLOXY- AND HETEROCYCLOALKYLOXYPYRIDINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR | JANSSEN PHARMACEUTICA NV (BE) | 2014-10-29 | — | — | EP | disclosed |