SCHEMBL30874943

SCHEMBL30874943

Cn1nncc1CC(=O)N1CCCC1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 10/20 0.44
▸ DPP9 Q86TI2 1/20 0.40
▸ HTR1A P08908 9/20 0.40
▸ HTR7 P34969 9/20 0.40
▸ VNN1 O95497 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
SCHEMBL30874974 0.80 DPP4 (0.44) DPP4DPP9HTR1AHTR7
SCHEMBL30874864 0.76 VNN1 (0.47) DPP4DPP9HTR1AHTR7VNN1
SCHEMBL30874955 0.76 DPP4 (0.42) DPP4DPP9HTR1AHTR7VNN1
SCHEMBL30874926 0.75 DPP4 (0.44) DPP4DPP9HTR1AHTR7
SCHEMBL30874947 0.75 DPP4 (0.39) DPP4DPP9HTR1AHTR7
SCHEMBL30874813 0.75 DPP4 (0.42) DPP4DPP9HTR1AHTR7
SCHEMBL26832564 0.74 TACR1 (0.47) —
SCHEMBL30341409 0.73 DPP4 (0.41) DPP4DPP9HTR1AHTR7
SCHEMBL30874874 0.73 VNN1 (0.44) DPP4DPP9HTR1AHTR7VNN1
SCHEMBL30874914 0.72 DPP4 (0.44) DPP4DPP9HTR1AHTR7

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
Send feedback