SCHEMBL7299922

SCHEMBL7299922

CS(=O)(=O)NC(=N)c1ccc(CC(N)C(=O)N2CCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.42
DPP7 Q9UHL4 7/20 0.42
DPP8 Q6V1X1 1/20 0.42
HDAC8 Q9BY41 4/20 0.40
ACACB O00763 1/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39

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
SCHEMBL7299915 1.00 DPP4 (0.42) DPP4DPP7DPP8HDAC8ACACB
Hydrochloric Acid SCHEMBL6763608 0.99 DPP4 (0.42) DPP4DPP7DPP8HDAC8ACACB
Hydrochloric Acid SCHEMBL6763615 0.99 DPP4 (0.42) DPP4DPP7DPP8HDAC8ACACB
SCHEMBL7299863 0.85 DPP7 (0.43) DPP4DPP7DPP8
SCHEMBL7289568 0.81 DPP7 (0.50) DPP4DPP7DPP8HDAC8
SCHEMBL7289575 0.81 DPP7 (0.50) DPP4DPP7DPP8HDAC8
Hydrochloric Acid SCHEMBL6768024 0.80 DPP7 (0.49) DPP4DPP7DPP8HDAC8
Hydrochloric Acid SCHEMBL6768028 0.80 DPP7 (0.49) DPP4DPP7DPP8HDAC8
SCHEMBL7449736 0.79 PRSS1 (0.51) DPP4DPP7DPP8HDAC8
SCHEMBL7450368 0.79 PRSS1 (0.51) DPP4DPP7DPP8HDAC8

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-1245568-A1 Sulfonyl derivatives of amino acids and their use as inhibitors of dipeptidyl-peptidase IV (DPP IV) Les Laboratoires Servier (FR) 2002-10-02 EP disclosed