SCHEMBL30596254

SCHEMBL30596254

CCOc1nc(Cl)cc2c1cnn2CC(=O)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 9/20 1.00
PDE4B Q07343 2/20 0.64
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
TP53 P04637 2/20 0.37
CNR2 P34972 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
KMO O15229 1/20 0.34
MAPT P10636 1/20 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
SCHEMBL30596249 0.87 PDE4D (0.77) PDE4DPDE4BNPC1RAB9ATP53
SCHEMBL30596265 0.79 PDE4D (0.71) PDE4DPDE4BCNR2MEN1KMT2A
SCHEMBL30596272 0.73 PDE4D (0.59) PDE4DPDE4BNPC1RAB9AMEN1
SCHEMBL30596261 0.73 PDE4D (0.59) PDE4DPDE4BMEN1KMT2APOLB
SCHEMBL30596250 0.69 PDE4D (1.00) PDE4DPDE4B
SCHEMBL30596266 0.64 PDE4D (0.49) PDE4DPDE4BNPC1RAB9AMEN1
SCHEMBL30596271 0.63 PDE4D (0.78) PDE4DPDE4BPOLB
SCHEMBL16965743 0.63 PDE4D (0.47) PDE4DPDE4BRAB9AKMT2AMAPT
SCHEMBL16505774 0.62 PDE4D (0.44) PDE4DPDE4BKMT2A
SCHEMBL29950317 0.62 PDE4D (0.44) PDE4DPDE4BKMT2A

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