SCHEMBL27356571

SCHEMBL27356571

NC(=O)C(CCCCNC(=O)OCc1ccccc1)NC(=O)OC12CC3CC(CC(N)(C3)C1)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 2/20 0.50
▸ FOLH1 Q04609 2/20 0.47
▸ MMP2 P08253 3/20 0.45
▸ MMP9 P14780 3/20 0.45
▸ DPP8 Q6V1X1 1/20 0.44
▸ DPP7 Q9UHL4 1/20 0.44
▸ CTSL P07711 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CPB1 P15086 1/20 0.43
▸ CPB2 Q96IY4 1/20 0.43
▸ KLK7 P49862 1/20 0.43
▸ KLK5 Q9Y337 1/20 0.43
▸ F13A1 P00488 1/20 0.43
▸ TGM2 P21980 1/20 0.43
▸ TGM1 P22735 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.42
▸ MMP1 P03956 1/20 0.42
▸ MMP3 P08254 1/20 0.42
▸ MMP7 P09237 1/20 0.42

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
SCHEMBL30685026 0.97 SIRT2 (0.52) SIRT2FOLH1MMP2MMP9DPP8
SCHEMBL27356568 0.86 SIRT2 (0.48) SIRT2FOLH1MMP2MMP9DPP8
SCHEMBL30685198 0.79 DPP8 (0.59) DPP8
SCHEMBL27356370 0.79 DPP8 (0.59) DPP8
SCHEMBL26212052 0.78 DPP8 (0.49) SIRT2FOLH1MMP2MMP9DPP8
SCHEMBL27356105 0.76 DPP8 (0.69) DPP8
SCHEMBL30685134 0.76 DPP8 (0.69) DPP8
SCHEMBL31679031 0.76 DPP8 (0.51) SIRT2FOLH1MMP2MMP9DPP8
SCHEMBL30341837 0.75 KLK7 (0.54) SIRT2CTSLKLK7KLK5
SCHEMBL22117406 0.75 SIRT2 (0.50) SIRT2FOLH1MMP2MMP9DPP8

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-2023233024-A1 DPP9 BINDING COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2023-12-07 — — WO disclosed
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