⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25070814 | 0.73 | — | — | |
| SCHEMBL19143528 | 0.73 | — | — | |
| SCHEMBL12291784 | 0.73 | — | — | |
| SCHEMBL642457 | 0.71 | — | — | |
| SCHEMBL12955160 | 0.71 | — | — | |
| SCHEMBL4624879 | 0.71 | — | — | |
| SCHEMBL25489132 | 0.71 | — | — | |
| SCHEMBL22906984 | 0.71 | — | — | |
| SCHEMBL26262588 | 0.71 | — | — | |
| SCHEMBL12234141 | 0.71 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016029146-A1 | SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE | UNIVERSITY OF WASHINGTON (US) | 2016-02-25 | — | — | WO | claimed |
| EP-1697400-B1 | BIPHENYL-SUBSTITUTED ANTIBACTERIAL MACROCYCLES | AICURIS GMBH & CO KG (DE) | 2011-05-25 | — | — | EP | disclosed |
| US-7235186-B2 | Organosilicon compounds comprising cyclodextrin radicals | WACKER CHEMIE AG (DE) | 2007-06-26 | — | — | US | disclosed |
| US-20060009592-A1 | Organosilicon compounds comprising cyclodextrin radicals | WACKER-CHEMIE GMBH (DE) | 2006-01-12 | — | — | US | disclosed |