⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6747830 | 0.70 | — | — | |
| Bicarbonate SCHEMBL1260607 | 0.67 | — | — | |
| SCHEMBL16417859 | 0.67 | — | — | |
| SCHEMBL10150955 | 0.67 | — | — | |
| SCHEMBL57743 | 0.67 | ACE (0.40) | — | |
| SCHEMBL8225575 | 0.67 | — | — | |
| SCHEMBL18462016 | 0.65 | — | — | |
| SCHEMBL2063233 | 0.63 | — | — | |
| SCHEMBL7744463 | 0.63 | — | — | |
| Glycolic Acid SCHEMBL1222 | 0.63 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118324736-A | Preparation method of sugar carbene, carboglycosidic glycosyl boron compound and synthesis method thereof | 南开大学 | 2024-07-12 | — | — | CN | claimed |
| CN-118324736-A | Preparation method of sugar carbene, carboglycosidic glycosyl boron compound and synthesis method thereof | 南开大学 | 2024-07-12 | — | — | CN | disclosed |
| US-20080160028-A1 | SUBSTITUTED PYRIDO [3', 2': 4, 5] THIENO [3, 2-D] PYRIMIDINES AND PYRIDO [3', 2': 4, 5] FURO [3, 2-D] PYRIMIDINES USED AS INHIBITORS OF THE PDE-4 AND/OR THE RELEASE OF TNF-ALPHA | THE MEDICINES COMPANY (LEIPZIG) GMBH (DE) | 2008-07-03 | — | — | US | disclosed |