⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19852574 | 0.86 | — | — | |
| SCHEMBL20746328 | 0.82 | — | — | |
| SCHEMBL23635321 | 0.74 | — | — | |
| SCHEMBL23181682 | 0.73 | — | — | |
| SCHEMBL6920724 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL23635386 | 0.70 | DPP4 (0.31) | — | |
| SCHEMBL12197813 | 0.70 | TSHR (0.30) | — | |
| SCHEMBL2603301 | 0.68 | — | — | |
| SCHEMBL24700218 | 0.68 | KCNH2 (0.34) | — | |
| SCHEMBL19404264 | 0.67 | — | — |
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-11155538-B2 | Bicyclic CX3CR1 receptor agonists | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2021-10-26 | — | — | US | disclosed |