⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7827975 | 1.00 | — | — | |
| SCHEMBL7827973 | 1.00 | — | — | |
| SCHEMBL4281313 | 1.00 | — | — | |
| SCHEMBL3237030 | 0.84 | MEN1 (0.33) | — | |
| SCHEMBL4282805 | 0.84 | MEN1 (0.33) | — | |
| SCHEMBL15203580 | 0.76 | GAA (0.32) | — | |
| SCHEMBL376846 | 0.74 | MEN1 (0.33) | — | |
| SCHEMBL21110990 | 0.74 | MEN1 (0.33) | — | |
| SCHEMBL4284125 | 0.74 | HRH3 (0.32) | — | |
| SCHEMBL3229677 | 0.74 | HRH3 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090118169-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF | TOYAMA CHEMICAL CO., LTD. (JP) | 2009-05-07 | — | — | US | disclosed |
| US-7314888-B1 | Compounds and medicinal use thereof | TOYAMA CHEMICAL CO., LTD. (JP) | 2008-01-01 | — | — | US | disclosed |
| EP-1127869-A1 | NOVEL COMPOUNDS AND MEDICINAL USE THEREOF | TOYAMA CHEMICAL CO., LTD. (JP) | 2001-08-29 | — | — | EP | disclosed |