SCHEMBL6847248

SCHEMBL6847248

CCCC(CO)n1c(N)nc2[nH]cnc2c1=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.33
PDE4B Q07343 9/20 0.33
PDE4C Q08493 9/20 0.33
PDE4D Q08499 9/20 0.33
ADORA2A P29274 6/20 0.32
ADORA2B P29275 5/20 0.32
TLR8 Q9NR97 2/20 0.31
TLR7 Q9NYK1 1/20 0.31
PNP P00491 2/20 0.30
ADORA3 P0DMS8 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
SCHEMBL6847255 0.81 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL5021599 0.80 ADORA2B (0.43) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL15743132 0.78 ADORA2A (0.33) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL6751928 0.78 ADORA2B (0.35) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL473734 0.77 ADORA2A (0.32) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7862548 0.76 PNP (0.30) PNP
SCHEMBL2249841 0.74 HPRT1 (0.37) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL16106177 0.73 ADORA2A (0.37) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL5664356 0.72 PDE4A (0.33) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL874734 0.72 ADORA2A (0.45) PDE4APDE4BPDE4CPDE4DADORA2A

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-1372664-A1 USE OF CERTAIN STEROIDS FOR TREATMENT OF BLOOD CELL DEFICIENCIES Hollis-Eden Pharmaceuticals Inc. (US) 2004-01-02 EP disclosed
WO-2002069977-A1 USE OF CERTAIN STEROIDS FOR TREATMENT OF BLOOD CELL DEFICIENCIES HOLLIS-EDEN PHARMACEUTICALS, INC. (US) 2002-09-12 WO disclosed