SCHEMBL8245668

SCHEMBL8245668

Cc1cc([S+](C)[O-])cc2c(Nc3cccc(C#N)c3)c(C(N)=O)nnc12

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.50
PDE4A P27815 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
SYK P43405 3/20 0.38
CSF1R P07333 1/20 0.37
ZAP70 P43403 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 1/20 0.35
CSNK2A1 P68400 1/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LRRK2 Q5S007 1/20 0.35
EGFR P00533 1/20 0.34
ERBB2 P04626 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
SCHEMBL14007382 0.86 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL4607339 0.85 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL4607911 0.83 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL4606748 0.82 PDE4B (0.73) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL8259959 0.78 PDE4B (0.71) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL14007383 0.73 PDE4B (0.45) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL4606041 0.72 PDE4B (0.72) PDE4BCSF1RLRRK2
SCHEMBL4930884 0.72 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DSYK
SCHEMBL4608045 0.69 PDE4B (0.57) PDE4BCSF1RLRRK2
SCHEMBL8258162 0.68 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DSYK

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
WO-2007045861-A1 CINNOLINE COMPOUNDS AS INHIBITORS OF PHOSPHODIESTERASE TYPE IV (PDE4) GLAXO GROUP LIMITED (GB) 2007-04-26 WO disclosed