⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24542650 | 0.85 | LMNA (0.35) | — | |
| SCHEMBL12784741 | 0.81 | SLC6A1 (0.41) | — | |
| SCHEMBL4409084 | 0.81 | SLC6A1 (0.41) | — | |
| SCHEMBL1691629 | 0.81 | SLC6A1 (0.41) | — | |
| SCHEMBL25206007 | 0.80 | — | — | |
| SCHEMBL7893444 | 0.78 | HRH3 (0.41) | — | |
| SCHEMBL24759565 | 0.77 | — | — | |
| SCHEMBL22916041 | 0.77 | HRH3 (0.37) | — | |
| SCHEMBL21872595 | 0.75 | — | — | |
| SCHEMBL104444 | 0.75 | GNAO1 (0.37) | — |
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-20230159532-A1 | PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF | Crinetics Pharmaceuticals, Inc. | 2023-05-25 | — | — | US | disclosed |
| US-11254686-B1 | Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor | CORVUS PHARMACEUTICALS, INC. (US) | 2022-02-22 | — | — | US | disclosed |
| US-10301253-B2 | Therapeutic compounds and uses thereof | GENENTECH, INC. (US) | 2019-05-28 | — | — | US | disclosed |