SCHEMBL470566

SCHEMBL470566

N[C@H]1CN(Cc2ccccc2)C[C@@H]1c1ccc(Cl)cc1F

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.77
DRD2 P14416 3/20 0.50
DRD3 P35462 3/20 0.50
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
SIGMAR1 Q99720 3/20 0.44
CCR5 P51681 1/20 0.43
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL147328 0.88 DPP4 (0.63) DPP4DRD2DRD3HTR2AHTR2C
SCHEMBL147330 0.88 DPP4 (0.63) DPP4DRD2DRD3HTR2AHTR2C
SCHEMBL147329 0.88 DPP4 (0.63) DPP4DRD2DRD3HTR2AHTR2C
SCHEMBL1725958 0.88 DPP4 (0.63) DPP4DRD2DRD3HTR2AHTR2C
SCHEMBL149730 0.85 DPP4 (0.64) DPP4DRD2DRD3CCR5
SCHEMBL149732 0.85 DPP4 (0.64) DPP4DRD2DRD3CCR5
SCHEMBL461966 0.85 DPP4 (0.64) DPP4DRD2DRD3CCR5
SCHEMBL149731 0.85 DPP4 (0.64) DPP4DRD2DRD3CCR5
SCHEMBL14723602 0.85 DPP4 (0.61) DPP4DRD2DRD3HTR2CHTR2B
SCHEMBL14730265 0.85 DPP4 (0.61) DPP4DRD2DRD3HTR2CHTR2B

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed