⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3182678 | 0.91 | — | — | |
| SCHEMBL28460957 | 0.88 | — | — | |
| SCHEMBL28456217 | 0.88 | — | — | |
| SCHEMBL14845727 | 0.88 | — | — | |
| SCHEMBL8464176 | 0.80 | — | — | |
| SCHEMBL1130066 | 0.80 | — | — | |
| SCHEMBL3797243 | 0.79 | — | — | |
| SCHEMBL7217395 | 0.79 | ALDH1A1 (0.39) | — | |
| SCHEMBL541455 | 0.76 | TRPV1 (0.36) | — | |
| SCHEMBL10575988 | 0.73 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2007750-B1 | AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LTD (GB) | 2013-08-21 | — | — | EP | disclosed |
| US-7727988-B2 | Azabicyclo[3.1.0]hex-3-yl}alkyl)pyrimidinedione | GLAXO GROUP LIMITED (GB) | 2010-06-01 | — | — | US | disclosed |
| CN-101460485-A | Azabicyclo [3.1.0] hexyl derivatives as modulators of dopamine D3 receptor | GLAXO GROUP LTD (GB) | 2009-06-17 | — | — | CN | disclosed |
| EP-2007750-A1 | AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2008-12-31 | — | — | EP | disclosed |
| US-20070249642-A1 | Azabicyclo[3.1.0]hex-3-yl}alkyl)pyrimidinedione | GLAXO GROUP LIMITED (GB) | 2007-10-25 | — | — | US | disclosed |
| WO-2007113232-A1 | AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2007-10-11 | — | — | WO | disclosed |
| EP-0524829-A1 | Novel silane compound, process of preparing the same and plant growth regulator containing the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1993-01-27 | — | — | EP | disclosed |