⚠ 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 | |
|---|---|---|---|---|
| 1,2-Dibromoethane SCHEMBL4909802 | 1.00 | — | — | |
| 1,2-Dibromoethane SCHEMBL1698 | 0.91 | — | — | |
| 1,2-Dibromoethane SCHEMBL10589569 | 0.91 | — | — | |
| 1,2-Dibromoethane SCHEMBL11362087 | 0.83 | — | — | |
| 1,2-Dibromoethane SCHEMBL11706433 | 0.83 | — | — | |
| 1,2-Dibromoethane SCHEMBL2645474 | 0.83 | — | — | |
| 1,2-Dibromoethane SCHEMBL9067867 | 0.83 | — | — | |
| 1,2-Dibromoethane SCHEMBL9053813 | 0.77 | TSHR (0.71) | — | |
| 1,2-Dibromoethane SCHEMBL8713121 | 0.77 | — | — | |
| 1,2-Dibromoethane SCHEMBL9054556 | 0.77 | TSHR (0.71) | — |
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-20090233893-A1 | Methods of Dissolving Beta-Sheet Proteins and Uses Thereof | ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY | 2009-09-17 | — | — | US | disclosed |
| WO-2007139805-A2 | METHODS OF DISSOLVING BETA-SHEET PROTEINS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) | 2007-12-06 | — | — | WO | disclosed |