⚠ 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 | |
|---|---|---|---|---|
| Methoxyacetic Acid SCHEMBL48842 | 0.97 | — | — | |
| Methoxyacetic Acid SCHEMBL5068692 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL5069102 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL3796358 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL5859212 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL2771714 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL570981 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL2770038 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL9821635 | 0.93 | — | — | |
| Methoxyacetic Acid SCHEMBL18169479 | 0.93 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7411082-B2 | Synthesizing method for compound, and catalyst for synthesis reaction | CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) | 2008-08-12 | — | — | US | disclosed |
| US-20050215804-A1 | Synthesizing method for compound, and catalyst for synthesis reaction | CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) | 2005-09-29 | — | — | US | disclosed |