SCHEMBL6658246

SCHEMBL6658246

NC(CCCCC1CN(c2nccn2-c2ccccc2)CCN1)C(=O)N1CCSC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.49
DPP7 Q9UHL4 6/20 0.45
DPP8 Q6V1X1 2/20 0.45
DPP9 Q86TI2 2/20 0.45
ADRB1 P08588 2/20 0.35

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
SCHEMBL6658239 1.00 DPP4 (0.49) DPP4DPP7DPP8DPP9ADRB1
SCHEMBL6658241 1.00 DPP4 (0.49) DPP4DPP7DPP8DPP9ADRB1
SCHEMBL2855150 0.82 DPP4 (0.51) DPP4DPP7DPP8DPP9
SCHEMBL2855144 0.82 DPP4 (0.51) DPP4DPP7DPP8DPP9
SCHEMBL2859760 0.67 DPP4 (0.58) DPP4DPP7DPP8DPP9
SCHEMBL2859755 0.67 DPP4 (0.58) DPP4DPP7DPP8DPP9
SCHEMBL2859186 0.66 DPP4 (0.51) DPP4DPP7DPP8DPP9
SCHEMBL2859184 0.66 DPP4 (0.51) DPP4DPP7DPP8DPP9
SCHEMBL6678573 0.66 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL5375410 0.66 DPP4 (0.54) DPP4DPP7DPP8DPP9

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-1426366-A1 THIAZOLIDINE DERIVATIVE AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-06-09 EP disclosed