SCHEMBL4445115

SCHEMBL4445115

Clc1cccc(N2CCN(CCCOCc3ccn4nccc4c3)CC2)c1Cl.O=Cc1cnn2ccc(COCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc12

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.66
DRD4 P21917 20/20 0.66
DRD3 P35462 20/20 0.66
DRD1 P21728 14/20 0.66
HTR2A P28223 14/20 0.66

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
SCHEMBL3612900 0.94 DRD2 (0.73) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3613355 0.89 DRD2 (0.70) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3613900 0.80 DRD2 (1.00) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3619139 0.77 DRD2 (0.93) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3611189 0.74 DRD2 (0.88) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3615538 0.73 DRD3 (1.00) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3618443 0.72 DRD2 (1.00) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3609686 0.71 DRD2 (1.00) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3611252 0.71 DRD2 (0.82) DRD2DRD4DRD3DRD1HTR2A
SCHEMBL3611425 0.70 DRD2 (0.93) DRD2DRD4DRD3DRD1HTR2A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137185-A2 INDOLIZINES AND AZA-ANALOG DERIVATIVES THEREOF AS CNS ACTIVE COMPOUNDS Gmeiner, Dr. Peter (DE) 2009-12-30 EP claimed
WO-2008113559-A2 INDOLIZINES AND AZA-ANALOG DERIVATIVES THEREOF AS CNS ACTIVE COMPOUNDS SCHWARZ PHARMA AG (DE) 2008-09-25 WO claimed