SCHEMBL16840951

SCHEMBL16840951

CN1[C@H](C#N)CCC[C@@H]1C#N

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.41
DPP8 Q6V1X1 4/20 0.38
DPP9 Q86TI2 3/20 0.38
PREP P48147 1/20 0.36
DPP7 Q9UHL4 1/20 0.34

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
SCHEMBL15933326 1.00 DPP4 (0.41) DPP4DPP8DPP9PREPDPP7
SCHEMBL31375085 0.88 DPP4 (0.35) DPP4DPP8DPP9PREP
SCHEMBL20091976 0.85 DPP4 (0.41) DPP4DPP8DPP9PREPDPP7
SCHEMBL7155945 0.80 DPP4 (0.40) DPP4DPP8DPP9DPP7
SCHEMBL7856069 0.77 DPP4 (0.42) DPP4DPP8
SCHEMBL2760263 0.74
SCHEMBL12765086 0.74
SCHEMBL27378731 0.74
SCHEMBL7857991 0.74
SCHEMBL26007636 0.74

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-2015091584-A1 THIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS TYK2 KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2015-06-25 WO disclosed