⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2443 | 0.72 | — | — | |
| SCHEMBL5928 | 0.72 | — | — | |
| SCHEMBL330792 | 0.72 | — | — | |
| SCHEMBL538106 | 0.72 | — | — | |
| SCHEMBL162934 | 0.72 | — | — | |
| SCHEMBL20689771 | 0.67 | — | — | |
| SCHEMBL579521 | 0.67 | — | — | |
| Water SCHEMBL4451967 | 0.67 | TSHR (0.30) | — | |
| Iodide SCHEMBL10973607 | 0.67 | — | — | |
| SCHEMBL22749124 | 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-6288061-B1 | INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS | WELFIDE CORPORATION (JP) | 2001-09-11 | — | — | US | disclosed |
| CN-1063430-C | Ethanolamine derivatives | FUJISAWA PHARMACEUTICAL CO (JP) | 2001-03-21 | — | — | CN | disclosed |