⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11821011 | 0.92 | — | — | |
| SCHEMBL598887 | 0.84 | — | — | |
| SCHEMBL7563212 | 0.67 | CXCR4 (0.33) | — | |
| SCHEMBL17676886 | 0.65 | — | — | |
| SCHEMBL3048131 | 0.65 | — | — | |
| SCHEMBL24465796 | 0.65 | — | — | |
| SCHEMBL1549683 | 0.62 | — | — | |
| SCHEMBL24233686 | 0.62 | — | — | |
| SCHEMBL16878747 | 0.61 | — | — | |
| SCHEMBL6665645 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2506952-A1 | ABSORBENT SOLUTION CONTAINING A BREAKDOWN INHIBITOR DERIVED FROM PYRIMIDINE OR FROM TRIAZINE AND ABSORPTION PROCESS FOR ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT | IFP Energies nouvelles (FR) | 2012-10-10 | — | — | EP | disclosed |
| WO-2011064470-A1 | ABSORBENT SOLUTION CONTAINING A BREAKDOWN INHIBITOR DERIVED FROM PYRIMIDINE OR FROM TRIAZINE AND ABSORPTION PROCESS FOR ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT | IFP Energies Nouvelles (FR) | 2011-06-03 | — | — | WO | disclosed |