SCHEMBL10237495

SCHEMBL10237495

Cc1ccc(C23CC2CN(CCCS)C3)cc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 11/20 0.43
KCNH2 Q12809 11/20 0.43
DRD2 P14416 10/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL13823162 0.86 KCNH2 (0.49) DRD3KCNH2DRD2
SCHEMBL10237772 0.86 DRD2 (0.49) DRD3KCNH2DRD2
SCHEMBL14606195 0.85 DRD2 (0.53) DRD3KCNH2DRD2
SCHEMBL11459955 0.85 DRD3 (0.42) DRD3KCNH2DRD2
SCHEMBL4074941 0.84 KCNH2 (0.43) DRD3KCNH2DRD2
Hydrochloric Acid SCHEMBL11478772 0.84 DRD3 (0.42) DRD3KCNH2DRD2
Hydrochloric Acid SCHEMBL5447866 0.83 KCNH2 (0.42) DRD3KCNH2DRD2
SCHEMBL14606013 0.83 DRD3 (0.55) DRD3KCNH2DRD2
SCHEMBL6002385 0.81 KCNH2 (0.52) DRD3KCNH2DRD2
SCHEMBL4075128 0.81 KCNH2 (0.52) DRD3KCNH2DRD2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2060570-B1 Azabicyclo[3.1.0] hexane derivatives useful as modulators of dopamine D3 receptors GLAXO GROUP LTD (GB) 2012-01-25 EP disclosed
EP-2070922-A1 Azabicyclo(3.1.0) hexane derivatives useful as modulators of dopamine D3 receptors GLAXO GROUP LIMITED (GB) 2009-06-17 EP disclosed
EP-2060570-A2 Azabicyclo(3.1.0) hexane derivatives useful as modulators of dopamine D3 receptors Glaxo Group Limited (GB) 2009-05-20 EP disclosed