⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL272519 | 0.81 | — | — | |
| SCHEMBL17110647 | 0.81 | KDM1A (0.30) | — | |
| SCHEMBL396335 | 0.70 | CYP3A4 (0.41) | — | |
| SCHEMBL78459 | 0.70 | — | — | |
| SCHEMBL28232752 | 0.67 | — | — | |
| SCHEMBL27634277 | 0.67 | — | — | |
| SCHEMBL28779375 | 0.67 | — | — | |
| SCHEMBL27961218 | 0.67 | — | — | |
| SCHEMBL27779661 | 0.67 | — | — | |
| SCHEMBL9182733 | 0.66 | AHR (0.41) | — |
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-7381746-B2 | 2-Aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid derivative | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2008-06-03 | — | — | US | disclosed |
| US-20060142388-A1 | 2-Aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid derivative | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2006-06-29 | — | — | US | disclosed |