SCHEMBL6005281

SCHEMBL6005281

Cc1ccc(Oc2ccnc3ccc(OCC(C)(C)CO)cc23)c(-c2ncccn2)n1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 1/20 0.34
NUDT1 P36639 1/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
FGFR2 P21802 2/20 0.34
SRC P12931 2/20 0.33
TGFBR1 P36897 2/20 0.33
BTK Q06187 2/20 0.33
EGFR P00533 1/20 0.33
MET P08581 6/20 0.33
AXL P30530 5/20 0.33
KDR P35968 4/20 0.33
TEK Q02763 2/20 0.32
FLT4 P35916 1/20 0.32
TYRO3 Q06418 1/20 0.32
MERTK Q12866 1/20 0.32
AURKA O14965 1/20 0.32
LCK P06239 1/20 0.32

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
SCHEMBL6005366 0.91 PDGFRB (0.36) DDR2PDGFRBPDGFRAFGFR2SRC
SCHEMBL6004922 0.87 SLC22A12 (0.39) DDR2PDGFRBPDGFRASRCTGFBR1
SCHEMBL6005251 0.86 PDE2A (0.39) DDR2PDGFRBPDGFRASRCTGFBR1
SCHEMBL6004162 0.83 ALDH1A1 (0.36) DDR2PDGFRBPDGFRAFGFR2SRC
SCHEMBL6004262 0.83 ALDH1A1 (0.36) DDR2PDGFRBPDGFRASRCTGFBR1
SCHEMBL6004285 0.82 CYP3A4 (0.46)
SCHEMBL6004343 0.81 SIGMAR1 (0.36) DDR2PDGFRBPDGFRAFGFR2BTK
SCHEMBL6004146 0.80 SRC (0.38) PDGFRBPDGFRASRCTGFBR1KDR
SCHEMBL6004932 0.80 IRAK4 (0.39)
SCHEMBL6004333 0.79 PDGFRA (0.42) PDGFRBPDGFRATGFBR1AXL

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