⚠ 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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL11741263 | 0.86 | — | — | |
| SCHEMBL10340494 | 0.86 | — | — | |
| SCHEMBL4525854 | 0.86 | — | — | |
| Lithium Ion SCHEMBL4519203 | 0.86 | — | — | |
| SCHEMBL21980874 | 0.86 | — | — | |
| SCHEMBL8765298 | 0.86 | — | — | |
| SCHEMBL8005219 | 0.86 | — | — | |
| Potassium Ion SCHEMBL8431307 | 0.86 | CA4 (0.36) | — | |
| SCHEMBL2548303 | 0.86 | — | — | |
| SCHEMBL4508166 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991013551-A1 | PELLETIZED THIOCARBONATES FOR SOIL TREATMENT | UNION OIL COMPANY OF CALIFORNIA (US) | 1991-09-19 | — | — | WO | disclosed |