⚠ 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 | |
|---|---|---|---|---|
| Glycine SCHEMBL633951 | 0.82 | GLRA1 (0.37) | — | |
| SCHEMBL8416121 | 0.77 | SLC6A4 (0.38) | — | |
| SCHEMBL4940686 | 0.77 | SLC6A4 (0.38) | — | |
| SCHEMBL468003 | 0.77 | — | — | |
| SCHEMBL4856414 | 0.75 | SLC6A4 (0.40) | — | |
| SCHEMBL6443497 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL9255979 | 0.74 | — | — | |
| Bromide SCHEMBL28594415 | 0.74 | — | — | |
| SCHEMBL277864 | 0.74 | — | — | |
| SCHEMBL9446602 | 0.72 | SLC6A4 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020257487-A1 | GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE | BIOMARIN PHARMACEUTICAL INC. (US) | 2020-12-24 | — | — | WO | disclosed |
| WO-2005061507-A1 | BICYCLIC PYRAZOL-4-ONE CANNABINOID RECEPTOR LIGANDS AND USES THEREOF | PFIZER PRODUCTS INC. (US) | 2005-07-07 | — | — | WO | disclosed |
| US-5374772-A | Skin disorders, antiinflammatory agents, cardiovascular disorders | HOFFMANN-LAROCHE INC. (US) | 1994-12-20 | — | — | US | disclosed |