⚠ 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 | |
|---|---|---|---|---|
| Phosphonic Acid SCHEMBL11808087 | 0.82 | — | — | |
| Phosphonic Acid SCHEMBL908967 | 0.82 | ALDH1A1 (0.40) | — | |
| Phosphonic Acid SCHEMBL28415436 | 0.78 | — | — | |
| Phosphonic Acid SCHEMBL11240234 | 0.78 | — | — | |
| Phosphonic Acid SCHEMBL19305293 | 0.75 | — | — | |
| Phosphonic Acid SCHEMBL28421338 | 0.75 | — | — | |
| Phosphonic Acid SCHEMBL10708037 | 0.75 | — | — | |
| Phosphonic Acid SCHEMBL28348855 | 0.75 | — | — | |
| Phosphonic Acid SCHEMBL11858053 | 0.72 | — | — | |
| Phosphonic Acid SCHEMBL11139151 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100360546-C | Process for one-pot preparation of chloromethyl monosodium phosphonate | SOUTHWEST CHINA NORMAL UNIVERS (CN) | 2008-01-09 | — | — | CN | disclosed |
| CN-100360546-C | Process for one-pot preparation of chloromethyl monosodium phosphonate | SOUTHWEST CHINA NORMAL UNIVERS (CN) | 2008-01-09 | — | — | CN | disclosed |
| CN-1634941-A | Process for one-pot preparation of chloromethyl monosodium phosphonate | SOUTHWEST CHINA NORMAL UNIVERS (CN) | 2005-07-06 | — | — | CN | disclosed |