⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5447781 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL21204351 | 0.70 | — | — | |
| Sulfuric Acid SCHEMBL28423019 | 0.69 | FDPS (0.31) | — | |
| SCHEMBL7592318 | 0.67 | — | — | |
| SCHEMBL7164277 | 0.67 | — | — | |
| SCHEMBL25931318 | 0.65 | — | — | |
| SCHEMBL21979051 | 0.65 | — | — | |
| SCHEMBL1274213 | 0.65 | — | — | |
| SCHEMBL11220309 | 0.65 | — | — | |
| SCHEMBL10376904 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5783535-A | MIXTURES CONTAINING CONTROLLED AMOUNTS OF AMIDOETHER CARBOXYLIC ACIDS OR SALTS, AMIDOETHERS, GLYCERINE DERIVATIVES AND CONDITIONERS, FOR SHAMPOO, SKIN CLEANSING FOAM OR DISHWASHING DETERGENT | KAO CORPORATION (JP) | 1998-07-21 | — | — | US | disclosed |
| EP-0651632-A1 | HAIR COSMETIC COMPOSITION. | KAO CORP (JP) | 1995-05-10 | — | — | EP | disclosed |
| WO-1994002111-A1 | HAIR COSMETIC COMPOSITION | KAO CORPORATION (JP) | 1994-02-03 | — | — | WO | disclosed |