SCHEMBL7299863

SCHEMBL7299863

CS(=O)(=O)NC(=N)Nc1ccc(C[C@H](N)C(=O)N2CCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 6/20 0.43
DPP8 Q6V1X1 1/20 0.43
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
AKT1 P31749 2/20 0.41
FPR2 P25090 5/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
DPP4 P27487 1/20 0.40
FPR1 P21462 2/20 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
SCHEMBL7299922 0.85 DPP4 (0.42) DPP7DPP8DPP4
SCHEMBL7299915 0.85 DPP4 (0.42) DPP7DPP8DPP4
SCHEMBL7289568 0.84 DPP7 (0.50) DPP7DPP8KMT2ATP53MAPT
SCHEMBL7289575 0.84 DPP7 (0.50) DPP7DPP8KMT2ATP53MAPT
Hydrochloric Acid SCHEMBL6763615 0.84 DPP4 (0.42) DPP7DPP8DPP4
Hydrochloric Acid SCHEMBL6763608 0.84 DPP4 (0.42) DPP7DPP8DPP4
Hydrochloric Acid SCHEMBL6768028 0.83 DPP7 (0.49) DPP7DPP8KMT2ATP53MAPT
Hydrochloric Acid SCHEMBL6768024 0.83 DPP7 (0.49) DPP7DPP8KMT2ATP53MAPT
SCHEMBL5712136 0.81 DPP7 (0.41) DPP7DPP8AKT1FPR2DPP4
Hydrochloric Acid SCHEMBL6754486 0.80 DPP7 (0.41) DPP7DPP8FPR2DPP4FPR1

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