SCHEMBL30874974

SCHEMBL30874974

Cn1nccc1CC(=O)N1CCCC1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.44
▸ ACE P12821 1/20 0.43
▸ DPP9 Q86TI2 1/20 0.42
▸ HTR1A P08908 12/20 0.42
▸ HTR7 P34969 12/20 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
SCHEMBL30874943 0.80 DPP4 (0.44) DPP4DPP9HTR1AHTR7
SCHEMBL16277175 0.78 POLB (0.51) —
SCHEMBL30874862 0.76 CYP19A1 (0.47) DPP4ACEDPP9HTR1AHTR7
SCHEMBL30874915 0.76 DPP4 (0.45) DPP4ACEDPP9HTR1AHTR7
SCHEMBL30874955 0.76 DPP4 (0.42) DPP4ACEDPP9HTR1AHTR7
SCHEMBL30874846 0.75 DPP4 (0.47) DPP4DPP9HTR1AHTR7
SCHEMBL30874914 0.75 DPP4 (0.44) DPP4DPP9HTR1AHTR7
SCHEMBL30874876 0.74 DPP4 (0.39) DPP4DPP9HTR1AHTR7
SCHEMBL30874935 0.73 DPP4 (0.41) DPP4DPP9HTR1AHTR7
SCHEMBL13570397 0.73 DPP4 (0.49) DPP4ACEHTR1AHTR7

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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