SCHEMBL3639005

SCHEMBL3639005

COc1cc(C2CCN(C(=O)OCC(C)C)CC2)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.50
PDE4B Q07343 15/20 0.49
TLR9 Q9NR96 1/20 0.47
TLR8 Q9NR97 1/20 0.47
TLR7 Q9NYK1 1/20 0.47
TRPC6 Q9Y210 2/20 0.46
PDE4A P27815 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44

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
SCHEMBL20522882 0.83 PDE4B (0.56) QDPRPDE4BTRPC6PDE4APDE4C
SCHEMBL17076795 0.82 QDPR (0.55) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL15653074 0.82 QDPR (0.55) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL15651488 0.82 QDPR (0.55) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL13362034 0.81 QDPR (0.54) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL2227613 0.81 QDPR (0.59) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL3311407 0.81 QDPR (0.74) QDPRPDE4BTLR7PDE4APDE4C
SCHEMBL310046 0.81 PDE4B (0.62) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL30957975 0.81 PDE4B (0.62) QDPRPDE4BPDE4APDE4CPDE4D
SCHEMBL13362111 0.80 QDPR (0.55) QDPRPDE4BPDE4APDE4CPDE4D

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-2162454-A1 IMIDAZOPYRIDINE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-03-17 EP disclosed
WO-2008150799-A1 IMIDAZOPYRIDINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 WO disclosed