⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14716249 | 0.78 | SIRT2 (0.34) | — | |
| SCHEMBL14716300 | 0.76 | HRH1 (0.46) | — | |
| SCHEMBL14719005 | 0.69 | HRH1 (0.43) | — | |
| SCHEMBL14716694 | 0.67 | SIRT2 (0.33) | — | |
| SCHEMBL14716361 | 0.66 | HRH1 (0.51) | — | |
| SCHEMBL14716251 | 0.64 | HRH1 (0.41) | — | |
| SCHEMBL16638430 | 0.60 | KMT2A (0.43) | — | |
| SCHEMBL12480762 | 0.60 | SIRT2 (0.36) | — | |
| SCHEMBL17119768 | 0.60 | KMT2A (0.38) | — | |
| SCHEMBL13833888 | 0.59 | SIRT2 (0.37) | — |
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-8815843-B2 | Compounds and methods of treating diabetes | MEDIVATION TECHNOLOGIES, INC. (US) | 2014-08-26 | — | — | US | disclosed |
| US-20130053367-A1 | COMPOUNDS AND METHODS OF TREATING DIABETES | MEDIVATION TECHNOLOGIES, INC. | 2013-02-28 | — | — | US | disclosed |