SCHEMBL30874915

SCHEMBL30874915

NC(=O)C1CCCN1C(=O)Cc1ccno1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 10/20 0.45
▸ HTR1A P08908 7/20 0.43
▸ HTR7 P34969 7/20 0.43
▸ PREP P48147 1/20 0.42
▸ DPP9 Q86TI2 1/20 0.41
▸ VNN1 O95497 1/20 0.40
▸ ACE P12821 1/20 0.39

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
SCHEMBL13570435 0.78 VHL (0.52) DPP4HTR1AHTR7PREPDPP9
SCHEMBL21696738 0.78 VHL (0.52) DPP4HTR1AHTR7PREPDPP9
SCHEMBL30874862 0.77 CYP19A1 (0.47) DPP4HTR1AHTR7DPP9VNN1
SCHEMBL26134270 0.76 DPP4 (0.45) DPP4HTR1AHTR7ACE
SCHEMBL30874974 0.76 DPP4 (0.44) DPP4HTR1AHTR7DPP9ACE
SCHEMBL30874874 0.74 VNN1 (0.44) DPP4HTR1AHTR7PREPDPP9
SCHEMBL30874935 0.74 DPP4 (0.41) DPP4HTR1AHTR7DPP9VNN1
SCHEMBL13570397 0.74 DPP4 (0.49) DPP4HTR1AHTR7VNN1ACE
SCHEMBL30874840 0.74 DPP4 (0.49) DPP4HTR1AHTR7VNN1ACE
SCHEMBL2177077 0.74 DPP4 (0.57) DPP4HTR1AHTR7ACE

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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