⚠ 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 | |
|---|---|---|---|---|
| Acetaldehyde SCHEMBL28208784 | 0.89 | — | — | |
| Acetaldehyde SCHEMBL11771267 | 0.88 | — | — | |
| Acetaldehyde SCHEMBL27375667 | 0.87 | TSHR (1.00) | — | |
| Acetaldehyde SCHEMBL3945841 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL6747 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL2338299 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL20411618 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL1330497 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL1331732 | 0.87 | — | — | |
| Acetaldehyde SCHEMBL10893798 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101080280-A | Cobalt and nickel electroless plating in microelectronic devices | ENTHONE (US) | 2007-11-28 | — | — | CN | claimed |
| CN-110156105-A | A kind of environment-friendly boiler oxygen scavenger | 安徽省力皖节能环保科技有限公司 | 2019-08-23 | — | — | CN | disclosed |
| CN-101080280-A | Cobalt and nickel electroless plating in microelectronic devices | ENTHONE (US) | 2007-11-28 | — | — | CN | disclosed |
| US-5157122-A | Prepared by Fischer-Indole reaction with phosphorous pentoxide as second catalyst; regioselectivity; high yield; intermediates for leukotriene biosynthesis inhibitors | MERCK & CO., INC. (US) | 1992-10-20 | — | — | US | disclosed |