⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16919772 | 0.79 | CYP4F2 (0.31) | — | |
| SCHEMBL9516243 | 0.76 | — | — | |
| SCHEMBL17403391 | 0.74 | CYP4F2 (0.38) | — | |
| SCHEMBL3827004 | 0.73 | — | — | |
| SCHEMBL29740297 | 0.73 | HMGCR (0.31) | — | |
| SCHEMBL1063211 | 0.73 | — | — | |
| SCHEMBL28869957 | 0.73 | — | — | |
| SCHEMBL28080661 | 0.73 | — | — | |
| SCHEMBL11601652 | 0.73 | MEN1 (0.38) | — | |
| SCHEMBL9515430 | 0.72 | DGAT1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1427435-A1 | METHOD FOR RE-SENSITIZING VANCOMYCIN RESISTANT BACTERIA USING AGENTS WHICH SELECTIVELY CLEAVE A CELL WALL DEPSIPEPTIDE | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2004-06-16 | — | — | EP | disclosed |
| WO-2003035098-A1 | METHOD FOR RE-SENSITIZING VANCOMYCIN RESISTANT BACTERIA USING AGENTS WHICH SELECTIVELY CLEAVE A CELL WALL DEPSIPEPTIDE | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY O F NEW YORK (US) | 2003-05-01 | — | — | WO | disclosed |