SCHEMBL6674513

SCHEMBL6674513

Cn1c(=O)[nH]c(=O)c2c1nc(N1CCCC(N)C1)n2Cc1cc(F)cc(F)c1.Cn1c(=O)c2c(nc(N3CCCC(N)C3)n2Cc2cccc(F)c2)n(C)c1=O

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.66
TSHR P16473 5/20 0.57
ALDH1A1 P00352 5/20 0.57
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
ALOX15 P16050 1/20 0.51
KMT2A Q03164 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
MEN1 O00255 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
THRB P10828 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HTT P42858 1/20 0.49
CHRM1 P11229 1/20 0.48

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
SCHEMBL4668769 0.92 ALDH1A1 (0.59) DPP4TSHRALDH1A1MAPTALOX15
SCHEMBL555121 0.91 DPP4 (0.79) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL4668968 0.90 ALDH1A1 (0.56) DPP4TSHRALDH1A1MAPTALOX15
SCHEMBL555339 0.88 DPP4 (0.77) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL4668509 0.83 DPP4 (0.57) DPP4TSHRALDH1A1ALOX15KMT2A
SCHEMBL4669779 0.82 DPP4 (0.58) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL4668663 0.82 TSHR (0.73) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL556405 0.81 DPP4 (0.81) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL554872 0.81 DPP4 (0.81) DPP4TSHRALDH1A1LMNAMAPT
SCHEMBL555057 0.81 DPP4 (0.84) DPP4TSHRALDH1A1LMNAMAPT

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-2004033455-A2 HEMISUCCINATE SALTS OF HETEROCYCLIC DPP-IV INHIBITORS NOVO NORDISK A/S (DK) 2004-04-22 WO disclosed