SCHEMBL6181809

SCHEMBL6181809

CC(C)N(NCC(=O)N1CCCC1C#N)C1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.63
PREP P48147 2/20 0.57
DPP8 Q6V1X1 2/20 0.56
DPP9 Q86TI2 2/20 0.56

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
SCHEMBL26688737 0.78 DPP4 (1.00) DPP4PREPDPP8DPP9
SCHEMBL8261098 0.75 DPP4 (0.73) DPP4PREPDPP8DPP9
SCHEMBL4419337 0.74 DPP4 (0.82) DPP4DPP8DPP9
SCHEMBL4419343 0.74 DPP4 (0.82) DPP4DPP8DPP9
SCHEMBL4419347 0.74 DPP4 (0.82) DPP4DPP8DPP9
SCHEMBL18621797 0.74 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL13417345 0.74 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL7203181 0.73 DPP4 (0.70) DPP4PREPDPP8DPP9
SCHEMBL7203170 0.73 DPP4 (0.70) DPP4PREPDPP8DPP9
SCHEMBL16272853 0.72 DPP4 (0.69) DPP4PREPDPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1492777-A1 THIAZOLIDINE-4-CARBONITRILES AND ANALOGUES AND THEIR USE AS DIPEPTIDYL-PEPTIDASE INHIBITORS Torrent Pharmaceuticals Ltd (IN) 2005-01-05 EP claimed
WO-2003084940-A1 THIAZOLIDINE-4-CARBONITRILES AND ANALOGUES AND THEIR USE AS DIPEPTIDYL-PEPTIDAS INHIBITORS SANKARANARAYANAN ALANGUDI (IN) 2003-10-16 WO claimed