SCHEMBL13765700

SCHEMBL13765700

C=C(C)OC(=O)N1CCN(c2ncnc3cc(OCCN4CCCCC4)c(OC)cc23)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 19/20 0.64
CSF1R P07333 2/20 0.63
KIT P10721 2/20 0.63
FLT3 P36888 2/20 0.63
ACHE P22303 1/20 0.59
BACE1 P56817 1/20 0.59
PLK4 O00444 1/20 0.58
GAK O14976 1/20 0.58
EPHB6 O15197 1/20 0.58
STK10 O94804 1/20 0.58
EGFR P00533 1/20 0.58
NTRK1 P04629 1/20 0.58
LCK P06239 1/20 0.58
FGFR1 P11362 1/20 0.58
SRC P12931 1/20 0.58
PDGFRA P16234 1/20 0.58
FLT1 P17948 1/20 0.58
FGFR2 P21802 1/20 0.58
FGFR4 P22455 1/20 0.58
FGFR3 P22607 1/20 0.58

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
SCHEMBL13330552 0.87 PDGFRB (0.65) PDGFRBCSF1RKITFLT3PLK4
SCHEMBL2475194 0.83 PDGFRB (0.70) PDGFRBCSF1RKITFLT3PLK4
SCHEMBL7154857 0.80 TLR9 (0.65) PDGFRBCSF1RKITFLT3ACHE
SCHEMBL20828299 0.80 TLR9 (0.77) PDGFRBCSF1RKITFLT3ACHE
SCHEMBL1132488 0.80 KIT (0.65) PDGFRBKIT
SCHEMBL906341 0.78 PDGFRB (1.00) PDGFRB
SCHEMBL13330462 0.78 PDGFRB (1.00) PDGFRBCSF1RKITFLT3PLK4
SCHEMBL11797415 0.77 ACHE (0.76) PDGFRBKITFLT3ACHEBACE1
SCHEMBL13168045 0.77 PDGFRB (0.83) PDGFRBCSF1RKITFLT3PLK4
SCHEMBL13355149 0.77 PDGFRB (0.83) PDGFRBCSF1RKITFLT3PLK4

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-7560461-B2 Quinazoline derivatives as kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-07-14 US disclosed