⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28160141 | 0.80 | — | — | |
| SCHEMBL28134441 | 0.78 | — | — | |
| SCHEMBL27481758 | 0.77 | — | — | |
| SCHEMBL27722341 | 0.77 | — | — | |
| SCHEMBL28758057 | 0.75 | MEN1 (0.55) | — | |
| Hydrochloric Acid SCHEMBL4701970 | 0.75 | — | — | |
| Phosphoric Acid SCHEMBL27881838 | 0.73 | MMP2 (0.33) | — | |
| SCHEMBL3446955 | 0.72 | — | — | |
| SCHEMBL21378733 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL4203077 | 0.71 | MAPT (0.42) | — |
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-20140256663-A1 | Amphotericin Analogous Compounds and Pharmaceutical Compositions Containing Them | CENTRO DE INVESTIGACION Y DE ESTUDIOS AVANZADOS DEL INSTITUTO POLITECNICO AACION (MX) | 2014-09-11 | — | — | US | disclosed |