⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL806691 | 0.92 | GAA (0.33) | — | |
| SCHEMBL15344700 | 0.89 | — | — | |
| SCHEMBL15279898 | 0.89 | — | — | |
| SCHEMBL16455214 | 0.88 | TUBB4A (0.30) | — | |
| SCHEMBL23736080 | 0.86 | HDAC3 (0.34) | — | |
| SCHEMBL23314771 | 0.81 | PDE4A (0.32) | — | |
| SCHEMBL23314664 | 0.81 | — | — | |
| SCHEMBL17282702 | 0.81 | PDE4A (0.32) | — | |
| SCHEMBL15727144 | 0.81 | PDE4B (0.34) | — | |
| SCHEMBL15344732 | 0.81 | TUBB4A (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9187524-B2 | Broad spectrum antibiotic arylomycin analogs | THE SCRIPPS RESEARCH INSTITUTE (US) | 2015-11-17 | — | — | US | disclosed |
| US-20150045286-A1 | BROAD SPECTRUM ANTIBIOTIC ARYLOMYCIN ANALOGS | NAVY, SECRETARY OF THE UNITED STATES OF AMERICA | 2015-02-12 | — | — | US | disclosed |
| US-20130281360-A1 | BROAD SPECTRUM ANTIBIOTIC ARYLOMYCIN ANALOGS | THE SCIPPS RESEARCH INSTITUTE (US) | 2013-10-24 | — | — | US | disclosed |