⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2735995 | 0.90 | IDO1 (0.32) | — | |
| SCHEMBL13209034 | 0.90 | IDO1 (0.32) | — | |
| SCHEMBL1396689 | 0.90 | IDO1 (0.32) | — | |
| SCHEMBL31141331 | 0.90 | IDO1 (0.32) | — | |
| SCHEMBL1396771 | 0.82 | IDO1 (0.31) | — | |
| Propionic Acid SCHEMBL1044207 | 0.82 | — | — | |
| SCHEMBL13907239 | 0.81 | — | — | |
| Cyclopropane Carboxylic Acid SCHEMBL3008327 | 0.81 | APLNR (0.32) | — | |
| SCHEMBL5049182 | 0.80 | — | — | |
| SCHEMBL23483313 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8314271-B2 | Selective preparation of some 2-alkoxy-ethanol derivatives | FIRMENICH SA (CH) | 2012-11-20 | — | — | US | disclosed |
| US-8314271-B2 | Selective preparation of some 2-alkoxy-ethanol derivatives | FIRMENICH SA (CH) | 2012-11-20 | — | — | US | disclosed |
| EP-2200963-B1 | SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES | FIRMENICH & CIE (CH) | 2012-01-04 | — | — | EP | disclosed |
| US-20100197973-A1 | SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES | FIRMENICH SA (CH) | 2010-08-05 | — | — | US | disclosed |
| US-20100197973-A1 | SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES | FIRMENICH SA (CH) | 2010-08-05 | — | — | US | disclosed |