SCHEMBL30596246

SCHEMBL30596246

CCOc1nc(Cl)cc2nn(C3CCOCC3)cc12

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 7/20 0.60
PDE4B Q07343 1/20 0.50
LRRK2 Q5S007 1/20 0.41
IRAK4 Q9NWZ3 10/20 0.38
FLT3 P36888 1/20 0.37
SYK P43405 1/20 0.37

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 0.75 PDE4D (1.00) PDE4DPDE4BLRRK2
SCHEMBL30596260 0.70 PDE4D (0.86) PDE4DPDE4BIRAK4
SCHEMBL16985496 0.69 LRRK2 (0.53) LRRK2
SCHEMBL30596271 0.68 PDE4D (0.78) PDE4DPDE4BIRAK4
SCHEMBL31638144 0.68 FLT3 (0.38) PDE4DPDE4BFLT3SYK
SCHEMBL30596273 0.68 PDE4D (0.85) PDE4DPDE4BLRRK2
SCHEMBL31586421 0.67 IRAK4 (0.40) LRRK2IRAK4
SCHEMBL30596251 0.67 PDE4D (0.61) PDE4DPDE4B
SCHEMBL30596264 0.67 PDE4D (0.61) PDE4DPDE4B
SCHEMBL30596270 0.65 PDE4D (0.50) PDE4DPDE4B

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