SCHEMBL14722977

SCHEMBL14722977

Cc1cc(C2CN(Cc3ccccc3)CC2N)c(F)cc1F

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.58
DRD2 P14416 5/20 0.44
DRD3 P35462 5/20 0.44
DPP8 Q6V1X1 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
CCR5 P51681 2/20 0.40
FUCA1 P04066 2/20 0.39
ACHE P22303 1/20 0.39

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
SCHEMBL12064538 1.00 DPP4 (0.58) DPP4DRD2DRD3DPP8DPP7
SCHEMBL14722978 1.00 DPP4 (0.58) DPP4DRD2DRD3DPP8DPP7
SCHEMBL149732 0.91 DPP4 (0.64) DPP4DRD2DRD3DPP8DPP7
SCHEMBL149731 0.91 DPP4 (0.64) DPP4DRD2DRD3DPP8DPP7
SCHEMBL149730 0.91 DPP4 (0.64) DPP4DRD2DRD3DPP8DPP7
SCHEMBL461966 0.91 DPP4 (0.64) DPP4DRD2DRD3DPP8DPP7
SCHEMBL470654 0.86 DPP4 (0.60) DPP4DRD2DRD3CCR5ACHE
SCHEMBL1203772 0.84 DPP4 (0.60) DPP4DRD2DRD3CCR5FUCA1
SCHEMBL1203774 0.84 DPP4 (0.60) DPP4DRD2DRD3CCR5FUCA1
SCHEMBL1725958 0.83 DPP4 (0.63) DPP4DRD2DRD3CCR5FUCA1

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-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed