SCHEMBL30874917

SCHEMBL30874917

Cc1cnc(CC(=O)N2CC(F)CC2C(N)=O)o1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.41
▸ CFD P00746 3/20 0.38
▸ DPP4 P27487 5/20 0.37
▸ DPP8 Q6V1X1 3/20 0.37
▸ DPP7 Q9UHL4 3/20 0.37
▸ PIK3CA P42336 2/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ ITGA4 P13612 2/20 0.34
▸ CCNE1 P24864 4/20 0.34
▸ CDK2 P24941 4/20 0.34
▸ GSK3B P49841 3/20 0.34

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
SCHEMBL30874875 0.81 CNR2 (0.39) CNR2CFDDPP4DPP8DPP7
SCHEMBL30874910 0.80 CNR2 (0.39) CNR2CFDDPP4DPP8DPP7
SCHEMBL30874948 0.78 DPP4 (0.44) CNR2DPP4CCNE1CDK2GSK3B
SCHEMBL30341530 0.75 DPP4 (0.46) CNR2CFDDPP4DPP8DPP7
SCHEMBL30874836 0.74 CNR2 (0.37) CNR2CFDDPP4DPP8DPP7
SCHEMBL30874959 0.72 CNR2 (0.37) CNR2CFDPIK3CAPIK3CDPIK3CB
SCHEMBL10110426 0.72 PIN1 (0.42) CNR2DPP4DPP8DPP7PIK3CA
SCHEMBL30874811 0.71 CFD (0.40) CFDDPP4DPP8DPP7
SCHEMBL12757999 0.70 PIN1 (0.40) CNR2DPP4DPP8DPP7PIK3CA
SCHEMBL1493709 0.70 PIN1 (0.40) CNR2DPP4DPP8DPP7PIK3CA

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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