SCHEMBL7403997

SCHEMBL7403997

CCc1nn(-c2ccc(C(=O)O)cc2)c2c1CCN(c1ccc(OC)cc1)C2=O

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.76
PDE4B Q07343 7/20 0.76
PDE4C Q08493 7/20 0.76
PDE4D Q08499 7/20 0.76
F10 P00742 13/20 0.58
F2 P00734 3/20 0.56
SLC29A1 Q99808 1/20 0.55

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
SCHEMBL7400362 0.90 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL7374330 0.87 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL15490608 0.87 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL15490610 0.84 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL7376573 0.81 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL20100170 0.79 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL15175082 0.79 F10 (0.69) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL20100168 0.79 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL28369185 0.79 F10 (0.79) PDE4APDE4BPDE4CPDE4DF10
SCHEMBL5792812 0.78 F10 (0.64) PDE4APDE4BPDE4CPDE4DF10

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-0707585-A1 BICYCLIC TETRAHYDRO PYRAZOLOPYRIDINES PFIZER INC. (US) 1996-04-24 EP disclosed
WO-1995001980-A1 BICYCLIC TETRAHYDRO PYRAZOLOPYRIDINES PFIZER INC. (US) 1995-01-19 WO disclosed