SCHEMBL30874856

SCHEMBL30874856

NC(=O)C1CCCN1C(=O)Cc1c[nH]c(=O)cn1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 10/20 0.39
▸ DHFR P00374 1/20 0.39
▸ VNN1 O95497 1/20 0.38
▸ TRHR P34981 2/20 0.38
▸ DPP9 Q86TI2 1/20 0.37
▸ HTR1A P08908 2/20 0.36
▸ HTR7 P34969 2/20 0.36
▸ CNR2 P34972 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
SCHEMBL30874851 0.78 DPP4 (0.43) DPP4DHFRHTR1AHTR7
SCHEMBL30874909 0.77 VNN1 (0.47) DPP4DHFRVNN1DPP9HTR1A
SCHEMBL30874840 0.74 DPP4 (0.49) DPP4VNN1HTR1AHTR7
SCHEMBL13570397 0.74 DPP4 (0.49) DPP4VNN1HTR1AHTR7
SCHEMBL30874873 0.73 VNN1 (0.43) DPP4DHFRVNN1DPP9HTR1A
SCHEMBL30874864 0.72 VNN1 (0.47) DPP4DHFRVNN1DPP9HTR1A
SCHEMBL30341409 0.72 DPP4 (0.41) DPP4DPP9HTR1AHTR7
SCHEMBL30874914 0.71 DPP4 (0.44) DPP4DPP9HTR1AHTR7
SCHEMBL30874813 0.71 DPP4 (0.42) DPP4TRHRDPP9HTR1AHTR7
SCHEMBL30341550 0.71 DPP4 (0.46) DPP4VNN1DPP9HTR1AHTR7

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-117956985-A Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof 梅兹治疗公司 2024-04-30 — — CN disclosed
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