SCHEMBL2360197

SCHEMBL2360197

Cc1nc2cc3c(cc2o1)CCN(CCCSc1nnc(C2CCOC(=O)C2)n1C)CC3

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 20/20 0.79
KCNH2 Q12809 16/20 0.59
HRH1 P35367 1/20 0.59
DRD2 P14416 1/20 0.49

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
SCHEMBL2308553 0.88 DRD3 (1.00) DRD3KCNH2HRH1DRD2
Hydrochloric Acid SCHEMBL2308190 0.88 DRD3 (0.98) DRD3KCNH2HRH1DRD2
SCHEMBL5555680 0.75 DRD3 (0.79) DRD3KCNH2HRH1DRD2
SCHEMBL2310034 0.74 DRD3 (1.00) DRD3KCNH2HRH1DRD2
Hydrochloric Acid SCHEMBL2312980 0.73 DRD3 (0.98) DRD3KCNH2HRH1DRD2
SCHEMBL2313348 0.73 DRD3 (1.00) DRD3KCNH2HRH1
SCHEMBL2312613 0.72 DRD3 (1.00) DRD3KCNH2HRH1
Hydrochloric Acid SCHEMBL2309868 0.72 DRD3 (0.98) DRD3KCNH2HRH1
SCHEMBL2307625 0.71 DRD3 (1.00) DRD3KCNH2HRH1
Hydrochloric Acid SCHEMBL2313983 0.70 DRD3 (0.98) DRD3KCNH2HRH1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751163-B1 BENZAZEPINE COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF GLAXO GROUP LTD (GB) 2011-08-10 EP claimed