⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15871999 | 0.79 | HRH4 (0.32) | — | |
| SCHEMBL20099433 | 0.78 | HRH4 (0.33) | — | |
| SCHEMBL14228546 | 0.78 | HRH4 (0.33) | — | |
| SCHEMBL14365546 | 0.75 | — | — | |
| SCHEMBL18792499 | 0.72 | — | — | |
| SCHEMBL19002630 | 0.71 | POLB (0.40) | — | |
| SCHEMBL4671779 | 0.71 | — | — | |
| SCHEMBL12258940 | 0.70 | HRH4 (0.33) | — | |
| SCHEMBL3652736 | 0.70 | — | — | |
| SCHEMBL16382367 | 0.69 | HRH3 (0.30) | — |
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-8778874-B2 | Glycopeptide antibiotic monomer derivatives | NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) | 2014-07-15 | — | — | US | disclosed |
| US-20080097078-A1 | Antibacterial activity against vancomycin-resistant bacteria | SHIONOGI & CO., LTD. (JP) | 2008-04-24 | — | — | US | disclosed |