⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10081170 | 0.92 | — | — | |
| SCHEMBL13226872 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL13226831 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL10036589 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL10036582 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL13226912 | 0.90 | ALDH1A1 (0.52) | — | |
| SCHEMBL10194543 | 0.82 | — | — | |
| SCHEMBL10596487 | 0.78 | — | — | |
| SCHEMBL2547447 | 0.76 | — | — | |
| SCHEMBL4112856 | 0.76 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120088734-A1 | Cyclosporin Analogs | ALLERGAN, INC. (US) | 2012-04-12 | — | — | US | disclosed |
| US-8058429-B2 | Diazaphosphacycle transition metal complexes | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2011-11-15 | — | — | US | disclosed |
| US-20100222583-A1 | DIAZAPHOSPHACYCLE TRANSITION METAL COMPLEXES | WISCONSIN ALUMNI RESEARCH FOUNDATION | 2010-09-02 | — | — | US | disclosed |
| US-7771929-B2 | Tag library compounds, compositions, kits and methods of use | MONOGRAM BIOSCIENCES, INC. (US) | 2010-08-10 | — | — | US | disclosed |
| US-20080145785-A1 | Light sensitive planographic printing plate material | KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) | 2008-06-19 | — | — | US | disclosed |
| US-7355072-B2 | Diazaphosphacycle transition metal complexes | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2008-04-08 | — | — | US | disclosed |