SCHEMBL3701700

SCHEMBL3701700

COc1ccc(C(CN2C(=O)c3cccc(-n4cccc4)c3C2=O)S(C)(=O)=O)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 10/20 0.43
PDE4A P27815 6/20 0.43
PDE4B Q07343 6/20 0.43
PDE4C Q08493 6/20 0.43
PDE4D Q08499 6/20 0.43
TNF P01375 3/20 0.39

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
SCHEMBL825644 0.94 PDE4B (0.52) PDE4APDE4BPDE4CPDE4D
SCHEMBL6025567 0.81 PDE4B (0.64) PDE4APDE4BPDE4CPDE4D
SCHEMBL16702165 0.81 PDE4B (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL1583109 0.80 PDE4B (0.66) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5191733 0.79 PDE4B (0.51) PDE4APDE4BPDE4CPDE4D
SCHEMBL6421294 0.79 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL537167 0.78 PDE4B (0.68) UTS2RPDE4APDE4BPDE4CPDE4D
SCHEMBL5423831 0.77 PDE4B (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL825653 0.77 PDE4B (0.53) PDE4APDE4BPDE4CPDE4D
SCHEMBL9939312 0.76 PDE4B (0.52) PDE4APDE4BPDE4CPDE4DTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3142663-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS Celgene Corporation (US) 2017-03-22 EP disclosed
EP-3065778-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS Celgene Corporation (US) 2016-09-14 EP disclosed
WO-2015175956-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS CELGENE CORPORATION (US) 2015-11-19 WO disclosed
WO-2015069711-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS CELGENE CORPORATION (US) 2015-05-14 WO disclosed
EP-2395995-A1 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR TREATMENT, PREVENTION AND MANAGEMENT OF TUBERCULOSIS CELGENE CORPORATION (US) 2011-12-21 EP disclosed
WO-2010093588-A1 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR TREATMENT, PREVENTION AND MANAGEMENT OF TUBERCULOSIS CELGENE CORPORATION (US) 2010-08-19 WO disclosed