⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18674230 | 0.87 | — | — | |
| SCHEMBL18674228 | 0.85 | — | — | |
| SCHEMBL18674231 | 0.81 | — | — | |
| SCHEMBL17472194 | 0.75 | OGA (0.30) | — | |
| SCHEMBL17273886 | 0.75 | OGA (0.30) | — | |
| SCHEMBL17265254 | 0.74 | — | — | |
| SCHEMBL17274126 | 0.73 | OGA (0.31) | — | |
| SCHEMBL16155064 | 0.71 | — | — | |
| SCHEMBL16155025 | 0.71 | — | — | |
| SCHEMBL17265346 | 0.70 | — | — |
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-9738677-B2 | Amphotericin B derivative with reduced toxicity | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-08-22 | — | — | US | disclosed |
| US-20170088572-A1 | AMPHOTERICIN B DERIVATIVE WITH REDUCED TOXICITY | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2017-03-30 | — | — | US | disclosed |