SCHEMBL6608698

SCHEMBL6608698

CCC1CCN(C(=O)[C@@H](N)CCCC2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 8/20 0.45
DPP8 Q6V1X1 4/20 0.45
OPRK1 P41145 1/20 0.43
DPP4 P27487 2/20 0.39
DPP9 Q86TI2 2/20 0.38
EPHX2 P34913 1/20 0.38
FAP Q12884 1/20 0.38
ITGB3 P05106 3/20 0.38
ITGA2B P08514 3/20 0.38
OPRD1 P41143 1/20 0.37

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
SCHEMBL6608701 1.00 DPP7 (0.45) DPP7DPP8OPRK1DPP4DPP9
Hydrochloric Acid SCHEMBL6543701 0.99 DPP7 (0.44) DPP7DPP8OPRK1DPP4DPP9
Hydrochloric Acid SCHEMBL6543703 0.99 DPP7 (0.44) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL26039093 0.82 DPP4 (0.51) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL25499377 0.81 DPP4 (0.48) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL25500916 0.81 GNAI3 (0.50) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL26040756 0.78 DPP7 (0.47) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL24322713 0.77 DPP4 (0.53) DPP4
SCHEMBL26040010 0.77 DPP7 (0.46) DPP7DPP8OPRK1DPP4DPP9
SCHEMBL25499375 0.77 DPP4 (0.47) DPP7DPP8OPRK1DPP4DPP9

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-1268469-B1 N-(HETEROCYCLYL)BENZENE OR PYRIDINE SULPHONAMIDES AS ANTITHROMBOTIC AGENTS AND ANTICOAGULANTS SANOFI SYNTHELABO (FR) 2004-06-16 EP disclosed