⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7522715 | 0.71 | — | — | |
| SCHEMBL28911633 | 0.70 | — | — | |
| SCHEMBL3540344 | 0.70 | — | — | |
| SCHEMBL5702732 | 0.70 | — | — | |
| SCHEMBL991570 | 0.69 | — | — | |
| SCHEMBL8775519 | 0.69 | — | — | |
| SCHEMBL15622881 | 0.67 | — | — | |
| SCHEMBL17200559 | 0.67 | — | — | |
| SCHEMBL5409569 | 0.67 | — | — | |
| SCHEMBL10392891 | 0.67 | — | — |
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-20050215495-A1 | Macrolide antibiotics | ALIHODZIC SULEJMAN | 2005-09-29 | — | — | US | disclosed |
| US-6423689-B1 | Peptidyl calcium channel blockers | WARNER-LAMBERT COMPANY | 2002-07-23 | — | — | US | disclosed |