SCHEMBL7052278

SCHEMBL7052278

COc1ccc(-c2c(Cl)cncc2Cl)c2c(C(N)=O)c(C(C)=O)oc12

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 17/20 0.52
PDE4B Q07343 13/20 0.52
PDE4A P27815 12/20 0.52
PDE4C Q08493 12/20 0.52
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34

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
SCHEMBL7052696 0.90 PDE4D (0.44) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7052721 0.89 PDE4D (0.43) PDE4DPDE4BPDE4APDE4CMKNK2
SCHEMBL7057558 0.87 PDE4B (0.48) PDE4DPDE4BPDE4APDE4CMKNK2
SCHEMBL7054167 0.84 PDE4D (0.40) PDE4DPDE4BPDE4APDE4C
SCHEMBL7048142 0.84 PDE4A (0.42) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7054654 0.84 PDE4D (0.44) PDE4DPDE4BPDE4APDE4C
SCHEMBL8357732 0.83 PDE4D (0.42) PDE4DPDE4BPDE4APDE4C
SCHEMBL7056176 0.83 PDE4D (0.48) PDE4DPDE4BPDE4APDE4C
SCHEMBL7051176 0.82 PDE4A (0.41) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL8352300 0.82 PDE4D (0.39) PDE4DPDE4BPDE4APDE4CTDP1

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 4 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
US-5972936-A Benzofuran carboxamides and their therapeutic use DARWIN DISCOVER LIMITED (GB) 1999-10-26 US 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