SCHEMBL6004869

SCHEMBL6004869

COc1cc2c(Oc3cc4cccnc4nc3-c3ccccc3)ccnc2cc1OCCO

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.46
TGFBR1 P36897 3/20 0.46
FGFR2 P21802 2/20 0.46
AXL P30530 1/20 0.43
PDGFRA P16234 3/20 0.43
KDR P35968 2/20 0.43
PDGFRB P09619 2/20 0.42
MET P08581 1/20 0.42
HDAC1 Q13547 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
SCHEMBL6002798 1.00 SRC (0.46) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL3895779 0.92 FGFR2 (0.53) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL6004257 0.89 PDPK1 (0.47) SRCTGFBR1FGFR2PDGFRAKDR
SCHEMBL6004096 0.89 PDPK1 (0.47) SRCTGFBR1FGFR2PDGFRAKDR
SCHEMBL3966922 0.87 SRC (0.45) SRCTGFBR1FGFR2PDGFRAKDR
SCHEMBL6005276 0.86 SRC (0.44) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL6002948 0.86 FGFR2 (0.47) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL6005269 0.86 FGFR2 (0.47) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL6004765 0.85 FGFR2 (0.45) SRCTGFBR1FGFR2AXLPDGFRA
SCHEMBL6004575 0.85 PDGFRB (0.48) SRCTGFBR1FGFR2AXLPDGFRA

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
EP-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed