SCHEMBL5757580

SCHEMBL5757580

Fc1cccc(Cc2c[nH]nc2-c2ccc(OC(F)F)c(OC3CCCO3)c2)c1F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.34
PDE4D Q08499 4/20 0.33
PDE4A P27815 2/20 0.32
GSK3B P49841 1/20 0.31
KCNH2 Q12809 1/20 0.31
PDE4C Q08493 1/20 0.30
IGF1R P08069 1/20 0.30
MPO P05164 1/20 0.30

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
SCHEMBL5758859 0.89 PDE4B (0.41) PDE4BPDE4DPDE4APDE4C
SCHEMBL5758291 0.88 PDE4B (0.34) PDE4BPDE4DPDE4A
SCHEMBL5756557 0.83 DHFR (0.33) PDE4BPDE4DPDE4APDE4C
SCHEMBL5756853 0.83 AKT1 (0.36) PDE4BPDE4DPDE4AGSK3BKCNH2
SCHEMBL5758448 0.80 PDE4B (0.40) PDE4BPDE4DPDE4APDE4C
SCHEMBL5759370 0.79 PDE4A (0.44) PDE4BPDE4DPDE4APDE4C
SCHEMBL3605916 0.78 PDE4D (0.49) PDE4D
SCHEMBL5755076 0.76 PDE4B (0.44) PDE4BPDE4DPDE4APDE4C
SCHEMBL5755717 0.74 PDE4B (0.44) PDE4BPDE4DPDE4APDE4CIGF1R
SCHEMBL5759453 0.74 PDE5A (0.38) PDE4BPDE4DPDE4APDE4C

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-1631568-A1 PYRAZOLE DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceuticals Corporation (US) 2006-03-08 EP disclosed
WO-2004094411-A1 PYRAZOLE DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-11-04 WO disclosed