SCHEMBL4626932

SCHEMBL4626932

Cc1cc(S(=O)(=O)N2CCOCC2)c2ncc(C(N)=O)c(Nc3cccc(C#N)c3)c2c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.59
PDE4A P27815 2/20 0.52
PDE4C Q08493 2/20 0.52
PDE4D Q08499 2/20 0.52
CNR1 P21554 1/20 0.47
CSF1R P07333 3/20 0.45
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
SYK P43405 2/20 0.40
CNR2 P34972 1/20 0.40
ZAP70 P43403 1/20 0.40

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
SCHEMBL4628792 0.90 PDE4B (0.57) PDE4BCSF1RGAAMAPTSYK
SCHEMBL4627712 0.88 PDE4B (0.54) PDE4BCSF1RGAAMAPT
SCHEMBL4627091 0.88 PDE4B (0.54) PDE4BCNR1CSF1RGAAMAPT
SCHEMBL4625955 0.88 PDE4B (0.73) PDE4BPDE4APDE4CPDE4DCNR1
SCHEMBL4952577 0.85 PDE4B (0.74) PDE4BPDE4APDE4CPDE4DCSF1R
SCHEMBL5402837 0.84 PDE4B (0.68) PDE4BPDE4APDE4CPDE4DCNR1
SCHEMBL4627471 0.81 PDE4B (0.47) PDE4BCSF1RGAAMAPTSYK
SCHEMBL4627716 0.81 PDE4B (0.60) PDE4BCSF1RGAAMAPT
SCHEMBL4627633 0.80 SYK (0.49) PDE4BPDE4APDE4CPDE4DCSF1R
SCHEMBL4628322 0.79 PDE4B (0.57) PDE4BCSF1RGAAMAPT

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
EP-1673086-B1 4-AMINOQUINOLINE-3-CARBOXAMIDE DERIVATIVES AS PDE4 INHIBITORS GLAXO GROUP LTD (GB) 2008-01-23 EP claimed