⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3760065 | 0.71 | — | — | |
| SCHEMBL20162286 | 0.71 | — | — | |
| SCHEMBL480 | 0.71 | — | — | |
| SCHEMBL11393166 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL436016 | 0.71 | — | — | |
| Water SCHEMBL3324524 | 0.71 | — | — | |
| Fluoride Ion SCHEMBL1773191 | 0.71 | — | — | |
| SCHEMBL177608 | 0.58 | — | — | |
| SCHEMBL23461972 | 0.00 | — | — | |
| Hydrogen Sulfide SCHEMBL23805181 | 0.00 | — | — |
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-5139738-A | Of chromium, nickel, tungsten, carbon, silicon, manganese, tantalum, titanium and cobalt | GENERAL ELECTRIC COMPANY (US) | 1992-08-18 | — | — | US | claimed |