⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14303471 | 1.00 | — | — | |
| SCHEMBL17286038 | 1.00 | — | — | |
| SCHEMBL14444141 | 1.00 | — | — | |
| SCHEMBL14444139 | 1.00 | — | — | |
| SCHEMBL84879 | 1.00 | — | — | |
| SCHEMBL18070254 | 1.00 | — | — | |
| SCHEMBL24398116 | 0.95 | EPHX1 (0.38) | — | |
| SCHEMBL17031971 | 0.95 | PDGFRB (0.33) | — | |
| SCHEMBL21211597 | 0.95 | EPHX1 (0.35) | — | |
| SCHEMBL19976043 | 0.95 | EPHX1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11834407-B2 | Substituted cyclohexanes as muscarinic M1 receptor and/or M4 receptor agonists | HEPTARES THERAPEUTICS LIMITED (GB) | 2023-12-05 | — | — | US | disclosed |
| EP-3110810-B1 | PYRAZOLE AMIDE DERIVATIVE | TEIJIN PHARMA LTD (JP) | 2018-05-02 | — | — | EP | disclosed |
| US-20180105491-A1 | PHARMACEUTICAL COMPOUNDS | NXERA PHARMA UK LIMITED (GB) | 2018-04-19 | — | — | US | disclosed |