SCHEMBL4427002

SCHEMBL4427002

CCOc1cc(C(CN2C(=O)c3cccc(Cc4ncc[nH]4)c3C2=O)S(C)(=O)=O)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.47
PDE4C Q08493 19/20 0.47
PDE4A P27815 13/20 0.47
PDE4D Q08499 13/20 0.47
HTR2B P41595 1/20 0.41

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
SCHEMBL5423831 0.84 PDE4B (0.55) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL6025567 0.83 PDE4B (0.64) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537096 0.83 PDE4B (0.70) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL2505049 0.82 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL5191733 0.82 PDE4B (0.51) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1583109 0.81 PDE4B (0.66) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL4426112 0.80 PDE4B (0.52) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL692129 0.80 PDE4B (0.47) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL825653 0.79 PDE4B (0.53) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL825644 0.79 PDE4B (0.52) PDE4BPDE4CPDE4APDE4DHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1750697-A4 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORP (US) 2009-08-26 EP disclosed
EP-1838294-A1 COMPOSITIONS COMPRISING PDE4 MODULATORS AND THEIR USE FOR THE TREATMENT OR PREVENTION OF AIRWAY INFLAMMATION CELGENE CORPORATION (US) 2007-10-03 EP disclosed
EP-1750697-A1 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORPORATION (US) 2007-02-14 EP disclosed
WO-2006065814-A1 COMPOSITIONS COMPRISING PDE4 MODULATORS AND THEIR USE FOR THE TREATMENT OR PREVENTION OF AIRWAY INFLAMMATION CELGENE CORPORATION (US) 2006-06-22 WO disclosed
WO-2005112918-A1 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORPORATION (US) 2005-12-01 WO disclosed