SCHEMBL27671561

SCHEMBL27671561

CN(C)CC1CNC(C(=O)OC(C)(C)C)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.33
ARG1 P05089 1/20 0.33
NR1H2 P55055 1/20 0.31

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
SCHEMBL29308168 0.83 NR1H2 (0.43) DPP4ARG1NR1H2
SCHEMBL934839 0.83 NR1H2 (0.43) DPP4ARG1NR1H2
SCHEMBL17715141 0.83 NR1H2 (0.43) DPP4ARG1NR1H2
SCHEMBL17715154 0.83 NR1H2 (0.43) DPP4ARG1NR1H2
SCHEMBL27600115 0.81 ARG1 (0.34) DPP4ARG1NR1H2
SCHEMBL16797265 0.81 ARG1 (0.34) DPP4ARG1NR1H2
SCHEMBL27418796 0.80 DPP4 (0.44) DPP4ARG1NR1H2
SCHEMBL6110183 0.77 KMT2A (0.34) DPP4ARG1NR1H2
SCHEMBL27618648 0.75 ARG1 (0.33) ARG1
SCHEMBL25930148 0.74 CTSC (0.36)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101456841-B Amide derivative and medicine NIPPON SHINYAKU CO LTD 2012-01-25 CN disclosed
CN-100526298-C Amide derivative and pharmaceutical NIPPON SHINYAKU CO LTD (JP) 2009-08-12 CN disclosed
CN-101456841-A Amide derivative and medicine NIPPON SHINYAKU CO LTD (JP) 2009-06-17 CN disclosed
CN-1898208-A Amide derivative and pharmaceutical NIPPON SHINYAKU CO LTD (JP) 2007-01-17 CN disclosed