SCHEMBL6854089

SCHEMBL6854089

N#C[C@@H]1CCCN1C(=O)CNC12CC3CC(O)CC(C1)C(C3)C2

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.79
DPP8 Q6V1X1 3/20 0.64
DPP9 Q86TI2 3/20 0.64
FAP Q12884 2/20 0.64
DPP7 Q9UHL4 1/20 0.51

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
SCHEMBL10063620 1.00 DPP4 (0.79) DPP4DPP8DPP9FAPDPP7
SCHEMBL10063621 1.00 DPP4 (0.79) DPP4DPP8DPP9FAPDPP7
SCHEMBL368008 0.89 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL13316742 0.89 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL16677087 0.83 DPP4 (0.69) DPP4DPP8DPP9FAP
SCHEMBL16666716 0.83 DPP4 (0.69) DPP4DPP8DPP9FAP
SCHEMBL16666714 0.83 DPP4 (0.69) DPP4DPP8DPP9FAP
SCHEMBL16667518 0.83 DPP4 (0.69) DPP4DPP8DPP9FAP
SCHEMBL5820943 0.83 DPP4 (0.71) DPP4DPP8DPP9FAP
SCHEMBL6853064 0.82 DPP4 (0.71) DPP4DPP8DPP9FAP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012022994-A1 PREPARATION PROCESS OF VILDAGLIPTIN EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2012-02-23 WO disclosed
WO-2011042765-A1 INORGANIC SALT COMPLEXES OF VILDAGLIPTIN EGIS GYÓGYSZERGYÁR NYILVÁNOSAN MÜKÖDÖ RÉSZVÉNY-TÁRSASÁG (HU) 2011-04-14 WO disclosed
EP-1513519-B1 THE USE OF SUBSTITUTED CYANOPYRROLIDINES FOR TREATING HYPERLIPIDEMIA NOVARTIS AG (CH) 2009-02-18 EP disclosed