⚠ 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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL7059627 | 0.73 | CA2 (0.33) | — | |
| SCHEMBL8961408 | 0.70 | LMNA (0.38) | — | |
| SCHEMBL8180732 | 0.67 | — | — | |
| SCHEMBL1584494 | 0.67 | — | — | |
| SCHEMBL319388 | 0.67 | — | — | |
| SCHEMBL4409893 | 0.66 | — | — | |
| SCHEMBL647006 | 0.66 | — | — | |
| SCHEMBL7059623 | 0.65 | SMPD1 (0.33) | — | |
| Phosphoric Acid SCHEMBL5485139 | 0.65 | CA2 (0.38) | — | |
| Phosphoric Acid SCHEMBL4423473 | 0.65 | CA2 (0.38) | — |
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-5532402-A | Process for producing optically active hydroxyalkylphosphonates | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1996-07-02 | — | — | US | disclosed |