⚠ 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 | |
|---|---|---|---|---|
| Glycolic Acid SCHEMBL872681 | 0.81 | — | — | |
| Glycolic Acid SCHEMBL1527708 | 0.81 | OR51E2 (0.44) | — | |
| Glycolic Acid SCHEMBL9698677 | 0.81 | OR51E2 (0.44) | — | |
| Glycolic Acid SCHEMBL10780240 | 0.81 | OR51E2 (0.44) | — | |
| Glycolic Acid SCHEMBL5315740 | 0.81 | OR51E2 (0.44) | — | |
| Glycolic Acid SCHEMBL243061 | 0.81 | — | — | |
| Glycolic Acid SCHEMBL6362687 | 0.80 | — | — | |
| Glycolic Acid SCHEMBL2518351 | 0.80 | LMNA (0.50) | — | |
| Glycolic Acid SCHEMBL1222 | 0.80 | — | — | |
| Glycolic Acid SCHEMBL811403 | 0.80 | LMNA (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3377612-A1 | FUNCTIONAL EXPRESSION OF MONOOXYGENASES AND METHODS OF USE | Industrial Microbes, Inc. (US) | 2018-09-26 | — | — | EP | disclosed |