⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20326169 | 0.82 | NOS2 (0.34) | — | |
| SCHEMBL19976746 | 0.77 | GCGR (0.32) | — | |
| SCHEMBL22880769 | 0.76 | — | — | |
| SCHEMBL24980083 | 0.74 | GCGR (0.32) | — | |
| SCHEMBL27401139 | 0.71 | PPARG (0.30) | — | |
| SCHEMBL16306932 | 0.70 | PNMT (0.32) | — | |
| SCHEMBL22800128 | 0.70 | GABRA1 (0.44) | — | |
| SCHEMBL26427277 | 0.69 | GCGR (0.32) | — | |
| SCHEMBL19976721 | 0.68 | GABRA1 (0.39) | — | |
| SCHEMBL10616520 | 0.66 | CA1 (0.43) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230023009-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | SPARCBIO LLC | 2023-01-26 | — | — | US | disclosed |
| US-20230026856-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | SPARCBIO LLC | 2023-01-26 | — | — | US | disclosed |