⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL450342 | 0.75 | — | — | |
| SCHEMBL15500218 | 0.73 | — | — | |
| SCHEMBL15870646 | 0.72 | — | — | |
| SCHEMBL9891729 | 0.71 | — | — | |
| SCHEMBL27474517 | 0.71 | — | — | |
| SCHEMBL7869221 | 0.69 | — | — | |
| SCHEMBL845124 | 0.67 | — | — | |
| SCHEMBL18255495 | 0.67 | — | — | |
| SCHEMBL17029366 | 0.67 | — | — | |
| SCHEMBL8375612 | 0.67 | — | — |
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-5178668-A | For masonry and wood; aqeuous mixture containing mixtures of alkali metal and organo-functional siliconates | GENERAL ELECTRIC COMPANY (US) | 1993-01-12 | — | — | US | disclosed |