SCHEMBL7051399

SCHEMBL7051399

COC(=O)c1cc2c(C(=O)O)ccc(OC)c2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 13/20 0.55
PDE4B Q07343 13/20 0.55
PDE4C Q08493 13/20 0.55
PDE4D Q08499 13/20 0.55
LMNA P02545 2/20 0.52
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
RECQL P46063 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL7056726 0.88 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7055897 0.87 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6839386 0.87 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL18384626 0.86 LMNA (0.54) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6839328 0.82 SMN1; SMN2 (0.62) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7053236 0.81 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7423948 0.81 PDE4D (0.48) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7053234 0.81 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7053230 0.81 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL309047 0.81 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DLMNA

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