⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2301660 | 0.69 | — | — | |
| SCHEMBL27294287 | 0.65 | TSHR (0.32) | — | |
| SCHEMBL1344356 | 0.65 | — | — | |
| SCHEMBL7525800 | 0.65 | — | — | |
| SCHEMBL7523798 | 0.65 | — | — | |
| SCHEMBL7191400 | 0.61 | — | — | |
| SCHEMBL1345692 | 0.60 | — | — | |
| SCHEMBL1980133 | 0.59 | TSHR (0.36) | — | |
| SCHEMBL8883207 | 0.59 | TSHR (0.31) | — | |
| SCHEMBL7454401 | 0.59 | TSHR (0.35) | — |
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-7276598-B2 | Phosphorylation reagents for improved processes to convert terminal hydroxyl groups of oligonucleotides into phosphate monoesters | SIGMA-ALDRICH CO. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20040230047-A1 | Coupling phosphoramidites; phosphates removable in one deprotection step; solid phase synthesis | PROLIGO, LLC (US) | 2004-11-18 | — | — | US | disclosed |