⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10296128 | 1.00 | — | — | |
| SCHEMBL22239183 | 0.82 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL23102141 | 0.82 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL21359152 | 0.82 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL14102105 | 0.81 | GAA (0.42) | — | |
| SCHEMBL23418589 | 0.81 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL10130074 | 0.78 | — | — | |
| SCHEMBL8173649 | 0.78 | — | — | |
| SCHEMBL12163326 | 0.78 | ADRB2 (0.40) | — | |
| SCHEMBL15481502 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160194358-A1 | LINEAR PEPTIDE ANTIBIOTCS | RQX PHARMACEUTICALS, INC. | 2016-07-07 | — | — | US | disclosed |