⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7746412 | 0.98 | — | — | |
| SCHEMBL5791268 | 0.87 | — | — | |
| SCHEMBL11209037 | 0.87 | — | — | |
| SCHEMBL1401808 | 0.84 | — | — | |
| Ethane SCHEMBL9435627 | 0.78 | — | — | |
| SCHEMBL27974157 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL14319853 | 0.77 | — | — | |
| Isobutanol SCHEMBL29108975 | 0.76 | TSHR (0.41) | — | |
| Methyl Alcohol SCHEMBL11431123 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL3974885 | 0.74 | KMT2A (0.30) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0980402-B1 | ENCRUSTATION AND BACTERIAL RESISTANT COATINGS FOR MEDICAL APPLICATIONS | ICET INC (US) | 2003-04-02 | — | — | EP | disclosed |
| EP-1047765-A1 | AQUEOUS CLEANING COMPOSITIONS IN DISPERSED LAMELLAR PHASE | THE PROCTER & GAMBLE COMPANY (US) | 2000-11-02 | — | — | EP | disclosed |
| EP-0980402-A4 | ENCRUSTATION AND BACTERIAL RESISTANT COATINGS FOR MEDICAL APPLICATIONS | ICET INC (US) | 2000-07-05 | — | — | EP | disclosed |
| EP-0980402-A1 | ENCRUSTATION AND BACTERIAL RESISTANT COATINGS FOR MEDICAL APPLICATIONS | ICET, INC. (US) | 2000-02-23 | — | — | EP | disclosed |
| US-5916534-A | SOLUBILIZING BASE METAL IN SLURRY BY ADDING SOLUBILIZING AGENTS | BUTLER DEAN (AU) | 1999-06-29 | — | — | US | disclosed |
| WO-1999027066-A1 | AQUEOUS CLEANING COMPOSITIONS IN DISPERSED LAMELLAR PHASE | THE PROCTER & GAMBLE COMPANY (US) | 1999-06-03 | — | — | WO | disclosed |
| US-5877243-A | BLEND OF A POLYMER AND SILVER PARTICLES | ICET, INC. (US) | 1999-03-02 | — | — | US | disclosed |
| WO-1998050461-A1 | ENCRUSTATION AND BACTERIAL RESISTANT COATINGS FOR MEDICAL APPLICATIONS | ICET, INC. (US) | 1998-11-12 | — | — | WO | disclosed |
| CN-1062375-A | The granulated detergent of amide-containing peroxyacid bleach and spices or bleaching composition | PROCTER & GAMBLE (US) | 1992-07-01 | — | — | CN | disclosed |