SCHEMBL6531039

SCHEMBL6531039

COCC(C)(C)NCC(=O)N1CCCC1C(=O)c1nnc(C)o1

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.81
DPP8 Q6V1X1 12/20 0.81
DPP7 Q9UHL4 11/20 0.81
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PKM P14618 1/20 0.40

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
SCHEMBL6529702 0.89 DPP4 (0.81) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6529279 0.88 DPP4 (0.82) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6530580 0.88 DPP4 (0.82) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6529125 0.86 DPP4 (0.61) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6531771 0.84 DPP4 (0.81) DPP4DPP8DPP7
SCHEMBL6531040 0.82 DPP4 (0.56) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6528898 0.81 DPP4 (0.75) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6527981 0.79 DPP4 (0.57) DPP4DPP8DPP7LMNARAB9A
SCHEMBL6531569 0.79 DPP4 (0.82) DPP4DPP8DPP7
SCHEMBL6532165 0.79 DPP4 (0.67) DPP4DPP8DPP7LMNARAB9A

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
WO-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed