SCHEMBL7053973

SCHEMBL7053973

COc1ccc(-c2ncc(C)cc2Br)c2c(C(N)=O)c(C(C)=O)oc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.38
PDE4B Q07343 6/20 0.38
PDE4C Q08493 6/20 0.38
PDE4D Q08499 6/20 0.38
MKNK2 Q9HBH9 4/20 0.35
SIK1 P57059 1/20 0.33
SIK2 Q9H0K1 1/20 0.33
SIK3 Q9Y2K2 1/20 0.33
LMNA P02545 2/20 0.32
RECQL P46063 1/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ABL1 P00519 1/20 0.31
RIN1 Q13671 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL7056667 0.81 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7056722 0.79 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7364178 0.77 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7055267 0.76 LMNA (0.40) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7362735 0.76 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7051026 0.75 POLB (0.42) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7054012 0.75 IKBKB (0.39) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7053044 0.75 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7052278 0.74 PDE4D (0.52) PDE4APDE4BPDE4CPDE4DMKNK2
SCHEMBL7053150 0.73 AAK1 (0.40) PDE4APDE4BPDE4CPDE4DMKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901482-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-05-02 EP disclosed
EP-0901482-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-03-17 EP disclosed
WO-1997044337-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1997-11-27 WO disclosed