SCHEMBL19909609

SCHEMBL19909609

O=C(CC12CC3CC(CC(O)(C3)C1)C2)N1CC[C@@H]2C[C@@H]21

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.64
BPTF Q12830 1/20 0.40
DPP8 Q6V1X1 2/20 0.38
DPP9 Q86TI2 2/20 0.38
FAP Q12884 1/20 0.37
GAA P10253 1/20 0.37
HSD11B1 P28845 1/20 0.37
POLB P06746 1/20 0.36
PREP P48147 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
SCHEMBL19909608 1.00 DPP4 (0.64) DPP4BPTFDPP8DPP9FAP
SCHEMBL19909647 0.77 DPP4 (0.45) DPP4BPTFDPP8DPP9FAP
SCHEMBL15600035 0.77 DPP4 (0.45) DPP4BPTFDPP8DPP9FAP
SCHEMBL19909607 0.76 BPTF (0.71) DPP4BPTFDPP8DPP9GAA
SCHEMBL18637917 0.75 DPP4 (0.40) DPP4BPTFDPP8DPP9GAA
SCHEMBL19909619 0.72 BPTF (0.46) DPP4BPTFDPP8DPP9GAA
SCHEMBL19909606 0.72 DPP4 (0.58) DPP4DPP8DPP9FAPPREP
SCHEMBL3171772 0.71 DPP4 (1.00) DPP4DPP8DPP9FAP
SCHEMBL19194507 0.71 DPP4 (1.00) DPP4DPP8DPP9FAP
SCHEMBL1788313 0.71 POLB (0.66) GAAHSD11B1POLB

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