SCHEMBL18596306

SCHEMBL18596306

COC(=O)N[C@H](C(=O)N1CCCC1)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.43
DPP7 Q9UHL4 13/20 0.43
TP53 P04637 1/20 0.41
PREP P48147 4/20 0.39
KCNH2 Q12809 1/20 0.36

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
SCHEMBL15458248 1.00 DPP4 (0.43) DPP4DPP7TP53PREPKCNH2
SCHEMBL15457806 0.95 TP53 (0.47) DPP4DPP7TP53
SCHEMBL15457807 0.95 DPP4 (0.49) DPP4DPP7TP53PREPKCNH2
SCHEMBL8356758 0.93 TP53 (0.49) DPP4DPP7TP53
SCHEMBL15458242 0.89 ALDH1A1 (0.40) DPP4DPP7TP53PREP
SCHEMBL18215143 0.84 AAK1 (0.44) PREP
SCHEMBL18215087 0.84 AAK1 (0.44) PREP
SCHEMBL28650981 0.84 AAK1 (0.44) PREP
SCHEMBL9102139 0.81 AAK1 (0.44) PREP
SCHEMBL9102145 0.81 AAK1 (0.44) PREP

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
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed