SCHEMBL6516455

SCHEMBL6516455

O=C([C@@H]1C[C@H](N2CCN(c3ccccc3)CC2)CN1)N1CCC(F)C1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.72
DPP8 Q6V1X1 4/20 0.72
DPP7 Q9UHL4 4/20 0.72
KCNH2 Q12809 1/20 0.56

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
SCHEMBL6516447 1.00 DPP4 (0.72) DPP4DPP8DPP7KCNH2
Hydrochloric Acid SCHEMBL2711225 0.84 DPP4 (0.72) DPP4DPP8DPP7KCNH2
SCHEMBL3840885 0.83 DPP4 (1.00) DPP4DPP8DPP7KCNH2
SCHEMBL3842844 0.83 DPP4 (1.00) DPP4DPP8DPP7KCNH2
SCHEMBL3840882 0.83 DPP4 (1.00) DPP4DPP8DPP7KCNH2
Hydrochloric Acid SCHEMBL2708846 0.79 DPP4 (0.98) DPP4DPP8KCNH2
SCHEMBL3840867 0.79 DPP4 (0.75) DPP4DPP8DPP7KCNH2
SCHEMBL3840863 0.79 DPP4 (0.75) DPP4DPP8DPP7KCNH2
SCHEMBL3849857 0.79 DPP4 (0.73) DPP4DPP8DPP7KCNH2
SCHEMBL3849862 0.79 DPP4 (0.73) DPP4DPP8DPP7KCNH2

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
JP-2005170792-A L-PROLINE DERIVATIVE AND USE OF THE SAME AS MEDICINE MITSUBISHI PHARMA CORP 2005-06-30 JP disclosed