SCHEMBL4704587

SCHEMBL4704587

COc1ccc2c(Cc3c(Cl)cncc3Cl)nnc(-c3sccc3OC(=O)O)c2c1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.65
PDE4B Q07343 20/20 0.65
PDE4C Q08493 20/20 0.65
PDE4D Q08499 20/20 0.65

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
SCHEMBL4704243 0.87 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL4704462 0.83 PDE4A (0.68) PDE4APDE4BPDE4CPDE4D
SCHEMBL6589533 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4702285 0.79 PDE4A (0.61) PDE4APDE4BPDE4CPDE4D
SCHEMBL4701819 0.78 PDE4A (0.77) PDE4APDE4BPDE4CPDE4D
SCHEMBL6586085 0.77 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4699913 0.77 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D
SCHEMBL4699266 0.76 PDE4D (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL4699341 0.76 PDE4D (0.63) PDE4APDE4BPDE4CPDE4D
SCHEMBL4699329 0.76 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D

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-1581229-B1 PHTHALAZINE DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS ZAMBON SPA (IT) 2008-03-12 EP claimed