SCHEMBL27903631

SCHEMBL27903631

CN(C)C(=O)C1CCC(N)C(NC(=O)O)C1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.33
▸ FASN P49327 3/20 0.33
▸ DPP4 P27487 1/20 0.32
▸ PDE7A Q13946 2/20 0.32
▸ GLI1 P08151 1/20 0.31
▸ MMP2 P08253 2/20 0.30
▸ MMP9 P14780 2/20 0.30
▸ CA12 O43570 2/20 0.30
▸ CA1 P00915 2/20 0.30
▸ CA2 P00918 2/20 0.30
▸ CA9 Q16790 2/20 0.30
▸ MMP1 P03956 1/20 0.30
▸ MMP3 P08254 1/20 0.30
▸ MMP8 P22894 1/20 0.30
▸ MMP13 P45452 1/20 0.30

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
SCHEMBL1503908 1.00 MME (0.33) MMEFASNDPP4PDE7AGLI1
Oxalic Acid SCHEMBL4114848 0.97 MME (0.32) MMEFASNDPP4PDE7A
Oxalic Acid SCHEMBL14908944 0.95 DPP4 (0.32) MMEFASNDPP4PDE7A
Sulfuric Acid SCHEMBL17472893 0.94 MME (0.31) MMEFASN
SCHEMBL20293628 0.89 MME (0.34) MMEFASNDPP4PDE7AGLI1
SCHEMBL20293481 0.89 MME (0.34) MMEFASNDPP4PDE7AGLI1
SCHEMBL20328936 0.87 FASN (0.38) MMEFASNMMP2MMP9MMP1
SCHEMBL31444622 0.85 BTK (0.36) —
SCHEMBL4632505 0.83 MME (0.33) MMEFASNDPP4PDE7AGLI1
SCHEMBL4632507 0.83 MME (0.33) MMEFASNDPP4PDE7AGLI1

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
CN-103080078-A Process for producing optically active diamine derivative salt DAIICHI SANKYO CO LTD 2013-05-01 — — CN disclosed
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