SCHEMBL30596248

SCHEMBL30596248

CCOc1nc(C(C)=O)cc2c1cnn2C1CCOCC1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.69
PDE1A P54750 9/20 0.42
PDE1B Q01064 9/20 0.42
PDE1C Q14123 9/20 0.42
MAPK1 P28482 2/20 0.41
PDE4B Q07343 3/20 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
SCHEMBL30596250 0.81 PDE4D (1.00) PDE4DPDE1APDE1BPDE1CPDE4B
SCHEMBL30596256 0.79 PDE4D (1.00) PDE4DPDE1APDE1BPDE1C
SCHEMBL30596269 0.77 PDE4D (0.67) PDE4DPDE1APDE1BPDE1CMAPK1
SCHEMBL30596273 0.74 PDE4D (0.85) PDE4DPDE1APDE1BPDE1CMAPK1
SCHEMBL30596262 0.74 PDE4D (0.62) PDE4DPDE1APDE1BPDE1CMAPK1
SCHEMBL30984353 0.67 PDE4B (0.49) PDE4DPDE4B
SCHEMBL30596258 0.67 PDE4D (0.73) PDE4DPDE1APDE1BPDE1CMAPK1
SCHEMBL12499545 0.67 EZH2 (0.59) PDE4DPDE1APDE1BPDE1CPDE4B
SCHEMBL17963332 0.65 PDE4B (0.57) PDE4DPDE4B
SCHEMBL23530017 0.65 PDE4D (0.41) PDE4DPDE1APDE1BPDE1CMAPK1

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-116836162-A Pyrazolo [4,3-c ] pyridine compound or pharmaceutically acceptable salt thereof and application thereof 南方医科大学 2023-10-03 CN disclosed