SCHEMBL7301534

SCHEMBL7301534

CS(=O)(=O)NCCCC[C@H](N)C(=O)N1CCSC1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.64
DPP7 Q9UHL4 8/20 0.64
DPP8 Q6V1X1 5/20 0.64
DPP9 Q86TI2 4/20 0.64
KCNH2 Q12809 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
SCHEMBL7301538 1.00 DPP4 (0.64) DPP4DPP7DPP8DPP9KCNH2
Hydrochloric Acid SCHEMBL6766584 0.99 DPP4 (0.62) DPP4DPP7DPP8DPP9KCNH2
Hydrochloric Acid SCHEMBL6766586 0.99 DPP4 (0.62) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL7299412 0.96 DPP4 (0.63) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL7299409 0.96 DPP4 (0.63) DPP4DPP7DPP8DPP9KCNH2
Hydrochloric Acid SCHEMBL6766564 0.95 DPP4 (0.61) DPP4DPP7DPP8DPP9KCNH2
Hydrochloric Acid SCHEMBL6766559 0.95 DPP4 (0.61) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL7289498 0.91 DPP7 (0.61) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL7289506 0.91 DPP7 (0.61) DPP4DPP7DPP8DPP9KCNH2
Hydrochloric Acid SCHEMBL6766509 0.90 DPP7 (0.59) DPP4DPP7DPP8DPP9KCNH2

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