SCHEMBL30596249

SCHEMBL30596249

CCOc1nc(Cl)cc2c1cnn2CC(=O)O

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 8/20 0.77
PDE4B Q07343 2/20 0.75
KMO O15229 1/20 0.47
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR2 P34972 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
S1PR2 O95136 2/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL30596254 0.87 PDE4D (1.00) PDE4DPDE4BKMOPOLBMEN1
SCHEMBL30596265 0.82 PDE4D (0.71) PDE4DPDE4BKMOMEN1KMT2A
SCHEMBL30596272 0.78 PDE4D (0.59) PDE4DPDE4BKMOKDM4EMEN1
SCHEMBL30596261 0.78 PDE4D (0.59) PDE4DPDE4BKMOKDM4EPOLB
SCHEMBL30596271 0.72 PDE4D (0.78) PDE4DPDE4BKDM4EPOLBS1PR2
SCHEMBL30596250 0.69 PDE4D (1.00) PDE4DPDE4B
SCHEMBL16965743 0.68 PDE4D (0.47) PDE4DPDE4BKDM4EHPGDKMT2A
SCHEMBL30596266 0.67 PDE4D (0.49) PDE4DPDE4BKDM4EHPGDHSD17B10
SCHEMBL13115663 0.66 KMO (0.51) PDE4DPDE4BKMOKDM4EHPGD
SCHEMBL16505774 0.65 PDE4D (0.44) PDE4DPDE4BKDM4EKMT2A

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