⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25489239 | 0.66 | KDM4E (0.49) | — | |
| SCHEMBL19057796 | 0.66 | TGM2 (0.44) | — | |
| SCHEMBL22268029 | 0.65 | GAA (0.42) | — | |
| SCHEMBL18721414 | 0.65 | MAP2K2 (0.30) | — | |
| SCHEMBL18798818 | 0.64 | FABP3 (0.37) | — | |
| SCHEMBL22064123 | 0.63 | NR4A2 (0.49) | — | |
| SCHEMBL23486417 | 0.63 | FABP4 (0.46) | — | |
| SCHEMBL20143351 | 0.63 | NPC1 (0.46) | — | |
| SCHEMBL19403907 | 0.62 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL27401064 | 0.62 | KMT2A (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210171503-A1 | GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF | ORFAN BIOTECH SL (ES) | 2021-06-10 | — | — | US | disclosed |