SCHEMBL6876513

SCHEMBL6876513

COc1ccc(-c2cccc(F)c2)n2nc(N)nc12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 13/20 0.48
FYN P06241 2/20 0.47
PDE10A Q9Y233 1/20 0.44
MAPT P10636 2/20 0.43
JAK1 P23458 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 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
SCHEMBL7145674 0.86 PDE10A (0.50) PDE4DPDE10AJAK1
SCHEMBL7043841 0.86 MAPT (0.51) PDE4DFYNPDE10AMAPTJAK1
SCHEMBL7146570 0.85 PDE4D (0.48) PDE4DFYNPDE10AMAPTJAK1
SCHEMBL7150018 0.84 DYRK3 (0.47) PDE4DFYNPDE10A
SCHEMBL2257907 0.84 MAPT (0.49) PDE4DFYNPDE10AMAPTJAK1
SCHEMBL2250839 0.84 PDE4D (0.64) PDE4DPDE10AMAPTJAK1
SCHEMBL7146861 0.81 PDE4D (0.70) PDE4DFYN
SCHEMBL510004 0.81 PDE4D (0.74) PDE4D
SCHEMBL7041043 0.81 PDE4D (0.46) PDE4DFYNMAPTJAK1
SCHEMBL7144542 0.78 PDE4D (0.53) PDE4DFYN

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
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US claimed
EP-1412352-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-28 EP disclosed
WO-2003010167-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-06 WO disclosed
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US disclosed