⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8624409 | 0.58 | — | — | |
| SCHEMBL1323076 | 0.56 | — | — | |
| SCHEMBL7887521 | 0.52 | — | — | |
| SCHEMBL11330344 | 0.50 | — | — | |
| SCHEMBL28520803 | 0.49 | — | — | |
| SCHEMBL22977587 | 0.48 | — | — | |
| Water SCHEMBL28533461 | 0.46 | — | — | |
| Water SCHEMBL28518656 | 0.46 | — | — | |
| SCHEMBL7647180 | 0.45 | — | — | |
| SCHEMBL157482 | 0.45 | — | — |
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-5858526-A | COMPRISING SILICON DIOXIDE OR METAL OXIDE COLLOIDS COATED IN A POLYVINYL MATERIAL SOLUBLE IN A WATER-CONTAINING ALCOHOLIC SOLVENT | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 1999-01-12 | — | — | US | disclosed |