SCHEMBL4067331

SCHEMBL4067331

CC(C)COC(=O)c1ccccc1C(=O)NC1CCC(CCN2CCc3ccc(C(=O)C(C)C)cc3CC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.57
DRD3 P35462 15/20 0.53

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
SCHEMBL5422623 0.90 DRD2 (0.54) DRD2DRD3
SCHEMBL5422618 0.90 DRD2 (0.54) DRD2DRD3
SCHEMBL4070417 0.85 DRD2 (0.55) DRD2DRD3
SCHEMBL4070422 0.85 DRD2 (0.55) DRD2DRD3
SCHEMBL4066834 0.84 DRD2 (0.54) DRD2DRD3
SCHEMBL4066835 0.84 DRD2 (0.54) DRD2DRD3
SCHEMBL4072634 0.83 DRD2 (0.59) DRD2DRD3
SCHEMBL4072636 0.83 DRD2 (0.59) DRD2DRD3
SCHEMBL4063566 0.80 DRD3 (0.59) DRD2DRD3
SCHEMBL4063561 0.80 DRD3 (0.59) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1725240-A4 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2009-03-25 EP claimed
EP-1725240-A1 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2006-11-29 EP claimed
WO-2005094834-A1 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2005-10-13 WO claimed
EP-1725240-A4 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2009-03-25 EP disclosed
EP-1725240-A1 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2006-11-29 EP disclosed
WO-2005094834-A1 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2005-10-13 WO disclosed