SCHEMBL28069698

SCHEMBL28069698

NCCC[C@@H](N)C(=O)N[C@H]([C]=O)CS

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 8/20 0.46
DPP8 Q6V1X1 6/20 0.46
DPP9 Q86TI2 6/20 0.46
DPP4 P27487 3/20 0.46
CPB2 Q96IY4 2/20 0.40
GSR P00390 1/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
RRM1 P23921 1/20 0.33
MMP2 P08253 1/20 0.33
SLC15A1 P46059 1/20 0.33

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
SCHEMBL2192260 0.95 DPP8 (0.47) DPP7DPP8DPP9DPP4CPB2
SCHEMBL2183058 0.85 DPP8 (0.42) DPP7DPP8DPP9DPP4CPB2
SCHEMBL7751944 0.83 DPP7 (0.50) DPP7DPP8DPP9DPP4GSR
SCHEMBL7751947 0.83 DPP7 (0.50) DPP7DPP8DPP9DPP4GSR
SCHEMBL11649726 0.81 DPP4 (0.50) DPP7DPP8DPP9DPP4
SCHEMBL11649721 0.81 DPP4 (0.50) DPP7DPP8DPP9DPP4
SCHEMBL3240642 0.81 DPP4 (0.50) DPP8DPP9DPP4GSR
SCHEMBL1534386 0.81 DPP4 (0.50) DPP8DPP9DPP4GSR
SCHEMBL7419957 0.80 NPY4R (0.39) DPP7DPP8DPP9DPP4GNAI3
SCHEMBL7419967 0.80 NPY4R (0.39) DPP7DPP8DPP9DPP4GNAI3

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
CN-105745218-A Removal of residual cell culture impurities 诺华股份有限公司 2016-07-06 CN disclosed