SCHEMBL6661726

SCHEMBL6661726

CC(Oc1c(C2CCN(CCCCN)CC2)ccc2c1CCCC2)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.37
DRD2 P14416 4/20 0.35
DRD3 P35462 3/20 0.35
MCHR1 Q99705 2/20 0.35
DRD4 P21917 2/20 0.35
CHRM1 P11229 1/20 0.34
CHRM3 P20309 8/20 0.33
HTR7 P34969 1/20 0.33
FAAH O00519 1/20 0.33

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
SCHEMBL6661716 0.91 DRD2 (0.39) DRD2DRD3MCHR1DRD4HTR7
SCHEMBL6664810 0.83 SLC6A4 (0.39) SLC6A4DRD2DRD3MCHR1DRD4
SCHEMBL6660513 0.83 SLC6A4 (0.37) SLC6A4DRD2DRD3MCHR1DRD4
SCHEMBL5937197 0.83 SLC6A4 (0.42) SLC6A4DRD2CHRM1CHRM3
SCHEMBL6796355 0.82 SLC6A4 (0.39) SLC6A4DRD2
SCHEMBL5899925 0.79 SLC6A4 (0.40) SLC6A4DRD2CHRM3
Hydrochloric Acid SCHEMBL5899865 0.79 SLC6A4 (0.39) SLC6A4DRD2CHRM3
SCHEMBL5937192 0.78 DRD2 (0.42) DRD2DRD3MCHR1DRD4HTR7
SCHEMBL6708008 0.78 SLC6A4 (0.40) SLC6A4DRD2
SCHEMBL6790396 0.78 DRD2 (0.39) DRD2DRD3MCHR1DRD4HTR7

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
WO-2004006923-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION FOR THE TREATMENT OF HYPERCHOLESTEROLEMIA GLAXO GROUP LIMITED (GB) 2004-01-22 WO claimed
WO-2004006923-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION FOR THE TREATMENT OF HYPERCHOLESTEROLEMIA GLAXO GROUP LIMITED (GB) 2004-01-22 WO disclosed