SCHEMBL7014973

SCHEMBL7014973

COc1ncc(C(=O)O)c2cc(C3CCOC3)oc12

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.65
PDE4B Q07343 11/20 0.65
PDE4A P27815 10/20 0.65
PDE4C Q08493 10/20 0.65
MAPT P10636 1/20 0.36
GCK P35557 1/20 0.34
DHODH Q02127 1/20 0.34
CNR2 P34972 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL7881905 0.94 PDE4D (0.58) PDE4DPDE4BPDE4APDE4CMAPT
SCHEMBL7011316 0.93 PDE4D (0.64) PDE4DPDE4BPDE4APDE4CMAPT
SCHEMBL7017070 0.81 PDE4A (0.54) PDE4DPDE4BPDE4APDE4CGCK
SCHEMBL7013236 0.80 PDE4A (0.55) PDE4DPDE4BPDE4APDE4CMAPT
SCHEMBL6606553 0.80 PDE4D (0.49) PDE4DPDE4BPDE4APDE4CMAPT
SCHEMBL7020524 0.74 PDE4D (0.52) PDE4DPDE4BPDE4APDE4CPIK3CA
SCHEMBL7016046 0.73 PDE4A (0.54) PDE4DPDE4BPDE4APDE4CMAPT
SCHEMBL7012791 0.72 PDE4A (0.45) PDE4DPDE4BPDE4APDE4C
SCHEMBL7017344 0.72 PDE4A (0.52) PDE4DPDE4BPDE4APDE4CGCK
SCHEMBL7010243 0.72 PDE4A (0.46) PDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086106-B1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LTD (GB) 2003-08-20 EP claimed
EP-1086106-A1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE Darwin Discovery Limited (GB) 2001-03-28 EP claimed
WO-1999064423-A1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LIMITED (GB) 1999-12-16 WO claimed
EP-1086106-B1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LTD (GB) 2003-08-20 EP disclosed
EP-1086106-A1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE Darwin Discovery Limited (GB) 2001-03-28 EP disclosed
US-6169090-B1 FOR INHIBITION OF PHOSPHODIESTERASE IV DARWIN DISCOVERY, LTD. (GB) 2001-01-02 US disclosed
WO-1999064423-A1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LIMITED (GB) 1999-12-16 WO disclosed