SCHEMBL13355149

SCHEMBL13355149

COc1cc2c(N3CCN(C(=O)Nc4ccc(O)cc4)CC3)ncnc2cc1OCCCN1CCCCC1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 20/20 0.83
KIT P10721 5/20 0.82
FLT3 P36888 5/20 0.82
CSF1R P07333 3/20 0.82
PLK4 O00444 1/20 0.82
GAK O14976 1/20 0.82
EPHB6 O15197 1/20 0.82
STK10 O94804 1/20 0.82
EGFR P00533 1/20 0.82
NTRK1 P04629 1/20 0.82
LCK P06239 1/20 0.82
FGFR1 P11362 1/20 0.82
SRC P12931 1/20 0.82
PDGFRA P16234 1/20 0.82
FLT1 P17948 1/20 0.82
FGFR2 P21802 1/20 0.82
FGFR4 P22455 1/20 0.82
FGFR3 P22607 1/20 0.82
AXL P30530 1/20 0.82
FLT4 P35916 1/20 0.82

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
SCHEMBL13168045 0.94 PDGFRB (0.83) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL13330543 0.93 PDGFRB (0.83) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL3315768 0.92 PDGFRB (0.81) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL906256 0.92 PDGFRB (0.81) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL12694513 0.91 PDGFRB (0.83) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL906260 0.91 PDGFRB (0.80) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL906352 0.91 PDGFRB (0.80) PDGFRBKITFLT3CSF1RPLK4
SCHEMBL906259 0.91 PDGFRB (0.80) PDGFRBKITFLT3CSF1RPLK4
Tandutinib SCHEMBL29393910 0.90 PDGFRB (1.00) PDGFRBKITFLT3CSF1RPLK4
Tandutinib SCHEMBL927974 0.90 PDGFRB (1.00) PDGFRBKITFLT3CSF1RPLK4

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
US-7709640-B2 Nitrogenous heterocyclic compounds and process for making nitrogenous heterocyclic compounds and intermediates thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed