⚠ 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 | |
|---|---|---|---|---|
| Methyl((Methylamino)Methyl)Phosphinic Acid SCHEMBL7018786 | 0.97 | — | — | |
| SCHEMBL10536457 | 0.77 | — | — | |
| Methyl Phosphonate SCHEMBL28018532 | 0.77 | CA2 (0.47) | — | |
| SCHEMBL64851 | 0.75 | — | — | |
| SCHEMBL11574911 | 0.75 | — | — | |
| Methyl((Methylamino)Methyl)Phosphinic Acid SCHEMBL21272008 | 0.75 | LPAR3 (0.50) | — | |
| SCHEMBL19544686 | 0.71 | — | — | |
| SCHEMBL18733003 | 0.71 | — | — | |
| SCHEMBL602847 | 0.70 | GABBR2 (0.58) | — | |
| SCHEMBL12730272 | 0.69 | TYMS (0.50) | — |
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-20030144249-A1 | Use of organophosphorous compounds for producing a medicament for treating infections | JOMAA PHARMAKA GMBH (DE) | 2003-07-31 | — | — | US | disclosed |