⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5449323 | 0.94 | TSHR (0.62) | — | |
| SCHEMBL259606 | 0.94 | — | — | |
| SCHEMBL9725066 | 0.88 | — | — | |
| Thiourea SCHEMBL9161381 | 0.80 | TSHR (0.86) | — | |
| Thiourea SCHEMBL27913683 | 0.80 | — | — | |
| Carbonotrithioic Acid SCHEMBL5547722 | 0.78 | CA1 (0.60) | — | |
| Thiourea SCHEMBL4933728 | 0.75 | — | — | |
| SCHEMBL1866989 | 0.75 | — | — | |
| SCHEMBL27856367 | 0.75 | — | — | |
| Thiourea SCHEMBL1008 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4149981-A | DISPERSION OF METAL SOAP AND OIL COMPONENTS IS VORTICAL BED OF FERROMAGNETIC PARTICLES FORMED UNDER ROTATING MAGNETIC FIELD | KAFAROV VIKTOR V | 1979-04-17 | — | — | US | disclosed |