⚠ 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 | |
|---|---|---|---|---|
| 2-Methoxyethanol SCHEMBL1317307 | 0.89 | TSHR (0.47) | — | |
| 2-Methoxyethanol SCHEMBL310 | 0.89 | — | — | |
| 2-Methoxyethanol SCHEMBL5050349 | 0.86 | — | — | |
| 2-Methoxyethanol SCHEMBL8506499 | 0.86 | — | — | |
| 2-Methoxyethanol SCHEMBL7944654 | 0.86 | TSHR (0.44) | — | |
| 2-Methoxyethanol SCHEMBL7703885 | 0.86 | TSHR (0.44) | — | |
| 2-Methoxyethanol SCHEMBL845462 | 0.86 | — | — | |
| 2-Methoxyethanol SCHEMBL4455759 | 0.86 | — | — | |
| 2-Methoxyethanol SCHEMBL21403186 | 0.86 | — | — | |
| 2-Methoxyethanol SCHEMBL6014126 | 0.86 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104945430-A | Preparation method of polyalcohol monomethyl ether trimethyl silane | ZHANGJIAGANG GUOTAI HUARONG NEW CHEMICAL MATERIALS | 2015-09-30 | — | — | CN | disclosed |