⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24916705 | 0.77 | CYP2C9 (0.32) | — | |
| SCHEMBL2089159 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL646711 | 0.72 | TYMP (0.31) | — | |
| SCHEMBL18480975 | 0.72 | RECQL (0.33) | — | |
| SCHEMBL18481135 | 0.71 | MEN1 (0.34) | — | |
| SCHEMBL24916768 | 0.70 | — | — | |
| SCHEMBL20047250 | 0.67 | RECQL (0.30) | — | |
| SCHEMBL24894493 | 0.64 | ESR1 (0.31) | — | |
| SCHEMBL14968577 | 0.63 | — | — | |
| SCHEMBL22909372 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023288033-A1 | ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES | LYCIA THERAPEUTICS, INC. (US) | 2023-01-19 | — | — | WO | disclosed |