SCHEMBL19909647

SCHEMBL19909647

C[C@H]1CCCN1C(=O)CC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.45
DPP8 Q6V1X1 3/20 0.44
FAP Q12884 2/20 0.44
DPP9 Q86TI2 2/20 0.44
PREP P48147 1/20 0.42
BPTF Q12830 1/20 0.42
ALDH1A1 P00352 1/20 0.42
DPP7 Q9UHL4 2/20 0.40
PITRM1 Q5JRX3 1/20 0.40
GAA P10253 1/20 0.39
HSD11B1 P28845 3/20 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
SCHEMBL15600035 1.00 DPP4 (0.45) DPP4DPP8FAPDPP9PREP
SCHEMBL7795161 0.79 DPP4 (0.71) DPP4DPP8FAPDPP9PREP
SCHEMBL12398808 0.78 DPP4 (0.47) DPP4DPP8FAPDPP9PREP
SCHEMBL19909607 0.77 BPTF (0.71) DPP4DPP8DPP9BPTFALDH1A1
SCHEMBL19909608 0.77 DPP4 (0.64) DPP4DPP8FAPDPP9PREP
SCHEMBL19909609 0.77 DPP4 (0.64) DPP4DPP8FAPDPP9PREP
SCHEMBL19909619 0.76 BPTF (0.46) DPP4DPP8DPP9BPTFALDH1A1
SCHEMBL18637917 0.74 DPP4 (0.40) DPP4DPP8DPP9BPTFALDH1A1
SCHEMBL10020810 0.72 DPP4 (0.64) DPP4DPP8FAPDPP9PREP
SCHEMBL1788313 0.70 POLB (0.66) ALDH1A1GAAHSD11B1

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-3122724-B1 A PROCESS FOR PRODUCING SAXAGLIPTIN ZENTIVA KS (CZ) 2018-02-28 EP disclosed