SCHEMBL1276223

SCHEMBL1276223

CS(=O)(=O)c1cc(Cl)c2ncc(C(N)=O)c(Nc3cccc(C#N)c3)c2c1.CS(=O)(=O)c1cc(Cl)c2ncc(C(N)=O)c(Nc3cccc4c3CCO4)c2c1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.64
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
CSF1R P07333 2/20 0.41
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL2478763 0.91 PDE4B (0.74) PDE4BCSF1RLRRK2
SCHEMBL2481381 0.87 PDE4B (0.82) PDE4BPDE4APDE4CPDE4DCSF1R
SCHEMBL1275589 0.82 PDE4B (0.75) PDE4BCSF1RLRRK2
Hydrochloric Acid SCHEMBL2481486 0.81 PDE4B (0.74) PDE4BCSF1RLRRK2
SCHEMBL1275366 0.81 PDE4B (0.74) PDE4BCSF1R
SCHEMBL2484127 0.81 PDE4B (0.73) PDE4BCSF1RLRRK2
SCHEMBL1275851 0.80 PDE4B (0.65) PDE4BCSF1RLRRK2
SCHEMBL1275607 0.79 PDE4B (0.64) PDE4BCSF1RLRRK2
SCHEMBL1275345 0.79 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DCSF1R
SCHEMBL4949456 0.78 PDE4B (0.67) PDE4BPDE4APDE4CPDE4DCSF1R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4625460-B2 2011-02-02 JP claimed
JP-2007501264-A 2007-01-25 JP claimed
EP-1633748-A1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-03-15 EP claimed
WO-2004103998-A1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-12-02 WO claimed