SCHEMBL905011

SCHEMBL905011

CC(=O)OC1(c2ccc(Cl)cc2)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 19/20 0.71
DRD4 P21917 17/20 0.71
DRD3 P35462 17/20 0.71
LMNA P02545 1/20 0.56
SIGMAR1 Q99720 1/20 0.56

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
SCHEMBL904897 0.91 DRD2 (0.58) DRD2DRD4DRD3LMNA
SCHEMBL905002 0.91 DRD3 (0.57) DRD2DRD4DRD3LMNA
SCHEMBL904932 0.90 DRD3 (0.57) DRD2DRD4DRD3
SCHEMBL904878 0.88 DRD2 (0.55) DRD2DRD4DRD3
SCHEMBL904887 0.85 OPRM1 (0.71) DRD2DRD4DRD3
SCHEMBL904917 0.85 DRD3 (0.52) DRD2DRD4DRD3LMNASIGMAR1
SCHEMBL904871 0.84 DRD2 (0.58) DRD2DRD4DRD3LMNASIGMAR1
SCHEMBL904854 0.83 DRD3 (0.50) DRD2DRD4DRD3LMNASIGMAR1
SCHEMBL8986083 0.83 DRD2 (1.00) DRD2DRD4DRD3
SCHEMBL904925 0.81 OPRM1 (0.52) DRD2DRD4DRD3LMNASIGMAR1

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
WO-2011143444-A2 DIPHENYLBUTYPIPERIDINE AUTOPHAGY INDUCERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-11-17 WO disclosed