⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL55353 | 0.83 | ALDH1A1 (0.37) | — | |
| SCHEMBL19418536 | 0.79 | — | — | |
| SCHEMBL3863161 | 0.79 | — | — | |
| SCHEMBL4826277 | 0.79 | — | — | |
| SCHEMBL9436380 | 0.79 | — | — | |
| SCHEMBL23384087 | 0.79 | — | — | |
| SCHEMBL55354 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL17225016 | 0.77 | — | — | |
| Hydrogen Sulfide SCHEMBL27463519 | 0.77 | LOX (0.32) | — | |
| SCHEMBL1500279 | 0.77 | ALDH1A1 (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023016999-A2 | Compounds | Cargene Therapeutics Pte. Ltd. (SG) | 2023-02-16 | — | — | WO | disclosed |
| US-20150191727-A1 | BICYCLIC CYCLOHEXOSE NUCLEIC ACID ANALOGS | ISIS PHARMACEUTICALS, INC. (US) | 2015-07-09 | — | — | US | disclosed |
| US-9045750-B2 | Humanized lewis-Y specific antibody-based delivery of dicer substrate siRNA (D-siRNA) against STAT3 | MA YUELONG (US) | 2015-06-02 | — | — | US | disclosed |
| US-9012421-B2 | Bicyclic cyclohexose nucleic acid analogs | ISIS PHARMACEUTICALS, INC. (US) | 2015-04-21 | — | — | US | disclosed |