SCHEMBL6528258

SCHEMBL6528258

CS(=O)(=O)N(c1nc(C(F)(F)F)nc2c1ncn2Cc1ccccc1F)S(C)(=O)=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.63
PDE4B Q07343 10/20 0.63
PDE4C Q08493 10/20 0.63
PDE4D Q08499 10/20 0.63
PDE5A O76074 3/20 0.63
PDE1A P54750 3/20 0.63
PDE1B Q01064 3/20 0.63
PDE1C Q14123 3/20 0.63
PDE3B Q13370 3/20 0.55
PDE3A Q14432 3/20 0.55
CNR2 P34972 6/20 0.44
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
YTHDC1 Q96MU7 2/20 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
SCHEMBL4517071 0.86 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL27611715 0.82 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4460149 0.80 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL4461234 0.78 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL3128315 0.78 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL3138769 0.78 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL185397 0.78 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL29798952 0.78 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL3141400 0.77 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL27631265 0.75 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551837-A1 PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2005-07-13 EP claimed
WO-2004014911-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-02-19 WO claimed