⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20181252 | 0.81 | — | — | |
| SCHEMBL18757258 | 0.81 | — | — | |
| SCHEMBL19839746 | 0.77 | — | — | |
| SCHEMBL1285795 | 0.75 | LMNA (0.47) | — | |
| SCHEMBL288820 | 0.75 | LMNA (0.47) | — | |
| SCHEMBL10527893 | 0.75 | LMNA (0.41) | — | |
| SCHEMBL14980830 | 0.73 | — | — | |
| SCHEMBL37218 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL22117628 | 0.73 | LMNA (0.45) | — | |
| SCHEMBL2099988 | 0.73 | THRB (0.40) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0943663-B1 | Alkylated aminoether surfactants | AIR PROD & CHEM (US) | 2004-11-10 | — | — | EP | disclosed |
| US-6492559-B1 | Alkylated aminoether surfactants | AIR PRODUCTS AND CHEMICALS, INC. | 2002-12-10 | — | — | US | disclosed |
| US-6190733-B1 | Alkylated aminoether surfactants | AIR PRODUCTS AND CHEMICALS, INC. | 2001-02-20 | — | — | US | disclosed |
| US-6051056-A | WATER-BASED COMPOSITIONS, PARTICULARLY COATING, INK, AND AGRICULTURAL COMPOSITIONS, MANIFESTING REDUCED EQUILIBRIUM AND DYNAMIC SURFACE TENSION BY THE INCORPORATION OF A SURFACE TENSION REDUCING AMOUNT OF CERTAIN ALKYLATED AMINOETHER | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2000-04-18 | — | — | US | disclosed |
| EP-0943663-A1 | Alkylated aminoether surfactants | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1999-09-22 | — | — | EP | disclosed |