SCHEMBL381569

SCHEMBL381569

COc1cc2c(O)ccnc2cc1OCN(C(=O)OCc1ccccc1)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.42
IRAK1 P51617 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
EGFR P00533 1/20 0.40
ADRA1D P25100 2/20 0.40
ADRA1A P35348 2/20 0.40
ADRA1B P35368 2/20 0.40
MET P08581 7/20 0.39
SRC P12931 1/20 0.39
TGFBR1 P36897 1/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
ELANE P08246 1/20 0.38
PDGFRA P16234 2/20 0.38
KDR P35968 1/20 0.38
KIT P10721 1/20 0.38

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
SCHEMBL18209921 0.90 PTGDR2 (0.42) PTGDR2IRAK1IRAK4EGFRADRA1D
SCHEMBL30465578 0.79 KDM1A (0.52) IRAK1IRAK4EGFRELANEPDGFRA
SCHEMBL18676689 0.79 KDM1A (0.52) IRAK1IRAK4EGFRELANEPDGFRA
SCHEMBL371659 0.79 KDM1A (0.52) IRAK1IRAK4EGFRELANEPDGFRA
SCHEMBL3869673 0.78 KDR (0.66) METKDR
SCHEMBL3861103 0.77 KDR (0.71) METKDR
SCHEMBL382035 0.77 KMT2A (0.49) PTGDR2
SCHEMBL453312 0.75 AXL (0.49) METKDR
SCHEMBL15880133 0.75 EHMT2 (0.40) METSRCTGFBR1PDGFRAKDR
SCHEMBL381568 0.74 MET (0.45) EGFRMETSRCTGFBR1TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408739-A1 A PROCESS FOR THE PREPARATION OF 6-(7-((1-AMINOCYCLOPROPYL)METHOXY)-6-METHOXYQUINOLIN-4-YLOXY)-N-METHYL-1-NAPHTHAMIDE AND SYNTHETIC INTERMEDIATES THEREOF EOS Ethical Oncology Science S.p.A. In Abbreviated From EOS S.p.A. (IT) 2012-01-25 EP disclosed
WO-2010105761-A1 A PROCESS FOR THE PREPARATION OF 6-(7-((1-AMINOCYCLOPROPYL)METHOXY)-6-METHOXYQUINOLIN-4-YLOXY)-N-METHYL-1-NAPHTHAMIDE AND SYNTHETIC INTERMEDIATES THEREOF EOS ETHICAL ONCOLOGY SCIENCE S.P.A. IN ABBREVIATED FORM EOS S.P.A. (IT) 2010-09-23 WO disclosed