SCHEMBL1727604

SCHEMBL1727604

NC(CN(CC=O)C(=O)O)C1CCN(c2ccc(-c3ccc(F)cc3)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
DRD4 P21917 1/20 0.41
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41
DRD3 P35462 1/20 0.41
DPP4 P27487 7/20 0.40
DPP8 Q6V1X1 7/20 0.40
DPP9 Q86TI2 7/20 0.40
DPP7 Q9UHL4 7/20 0.40
SCD O00767 1/20 0.39
DGAT1 O75907 3/20 0.39
ADORA2A P29274 3/20 0.39
KCNH2 Q12809 3/20 0.39
TDO2 P48775 2/20 0.39
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
HDAC10 Q969S8 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL1729059 0.91 DGAT1 (0.41) DGAT1ADORA2AKCNH2MCHR1L3MBTL1
SCHEMBL1730188 0.84 AKR1C3 (0.39) DPP4DPP8DPP9DPP7HRH3
SCHEMBL1730161 0.84 DEGS1 (0.43) HTR1ADRD4HTR2ADRD3DGAT1
SCHEMBL1729687 0.84 LMNA (0.53) DPP4DPP8DPP9DPP7HRH3
SCHEMBL1728785 0.83 HTR1A (0.41) HTR1ADRD4HTR2ADRD3DPP4
SCHEMBL1727973 0.83 HRH3 (0.44) HRH3
SCHEMBL1727913 0.81 HRH3 (0.38) HRH3
SCHEMBL1728838 0.81 DPP4 (0.40) HTR1ADPP4DPP8DPP9DPP7
SCHEMBL1730251 0.79 DPP4 (0.42) DPP4DPP8DPP9DPP7DGAT1
SCHEMBL1729774 0.78 LMNA (0.36) DPP4DPP8DPP9DPP7SCD

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
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed