⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4056307 | 0.89 | — | — | |
| SCHEMBL2820013 | 0.89 | — | — | |
| SCHEMBL4448662 | 0.87 | — | — | |
| SCHEMBL891380 | 0.87 | — | — | |
| SCHEMBL9747818 | 0.87 | — | — | |
| SCHEMBL11423607 | 0.75 | — | — | |
| SCHEMBL1215840 | 0.75 | — | — | |
| SCHEMBL1419806 | 0.75 | — | — | |
| SCHEMBL11150829 | 0.75 | — | — | |
| SCHEMBL9408868 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4217150-A | NON-POUROUS, SULFURIC ACID RESISTANT; MANGANESE, CHROMIUM, COPPER, NITROGEN, IRON | ALLEGHENY LUDLUM STEEL CORPORATION (US) | 1980-08-12 | — | — | US | disclosed |
| US-4000988-A | CATALYSTS, NICKEL, MAGNESIA, CHROMIA, COPPER OXIDE | JAPAN GASOLINE CO., LTD. (JA) | 1977-01-04 | — | — | US | disclosed |