SCHEMBL4747760

SCHEMBL4747760

COCCOc1cc2ncc3c(N)nc(NCc4ccccc4)nc3c2cc1OC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 10/20 0.56
PDGFRB P09619 2/20 0.49
PDGFRA P16234 2/20 0.49
EGFR P00533 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
LCK P06239 1/20 0.47
APP P05067 2/20 0.46
TLR7 Q9NYK1 1/20 0.43

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
SCHEMBL4747115 0.87 PDPK1 (0.55) PDPK1
SCHEMBL4746478 0.80 PDPK1 (0.52) PDPK1EGFR
SCHEMBL4747112 0.78 PDPK1 (0.53) PDPK1PDGFRBPDGFRA
SCHEMBL4747812 0.77 PDPK1 (0.56) PDPK1
SCHEMBL4747754 0.77 PDPK1 (0.68) PDPK1LMNATLR7
SCHEMBL4929414 0.74 PDPK1 (0.58) PDPK1EGFR
SCHEMBL4743599 0.74 PDPK1 (0.56) PDPK1
SCHEMBL4747109 0.73 PDPK1 (0.70) PDPK1KDM4EHPGDTLR7
SCHEMBL4745738 0.73 PDPK1 (0.61) PDPK1TLR7
SCHEMBL4747140 0.72 PDPK1 (0.43) PDPK1PDGFRBPDGFRAKDM4ETLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008109599-A1 PYRIMIDO [5,4-C] QUINOLINE-2, 4-DIAMINE DERIVATIVES AND METHODS OF USE THEREOF WYETH (US) 2008-09-12 WO claimed