SCHEMBL6984923

SCHEMBL6984923

C=CCNC(=Nc1c(C)cccc1Cl)Nc1ncnc2cc(OCCCN3CCCC3)c(OC)cc12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.52
KDR P35968 13/20 0.51
AURKA O14965 1/20 0.49
FGFR1 P11362 1/20 0.49
FLT1 P17948 1/20 0.49
FLT4 P35916 1/20 0.49
SRC P12931 2/20 0.49
RET P07949 2/20 0.49
EPHB4 P54760 3/20 0.49
EPHA2 P29317 2/20 0.49
CSK P41240 1/20 0.48
TEK Q02763 1/20 0.48
KIF5B P33176 1/20 0.48

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
SCHEMBL5828856 0.86 KDR (0.48) EGFRKDRFLT1FLT4SRC
SCHEMBL5828858 0.86 KDR (0.48) EGFRKDRFLT1FLT4SRC
SCHEMBL6985569 0.80 EGFR (0.56) EGFRKDRFGFR1FLT1FLT4
SCHEMBL7165079 0.80 KDR (0.59) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5496207 0.79 SRC (0.58) EGFRKDRAURKAFGFR1FLT1
SCHEMBL4687659 0.79 SRC (0.58) EGFRKDRAURKAFGFR1FLT1
SCHEMBL5828191 0.78 SRC (0.52) EGFRKDRAURKAFGFR1FLT1
SCHEMBL5828192 0.78 SRC (0.52) EGFRKDRAURKAFGFR1FLT1
SCHEMBL7091634 0.78 KDR (0.54) EGFRKDRAURKAFGFR1FLT1
SCHEMBL6980961 0.77 SRC (0.56) EGFRKDRAURKASRCRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1296973-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AstraZeneca AB (SE) 2003-04-02 EP claimed
WO-2002000644-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2002-01-03 WO claimed
EP-1296973-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AstraZeneca AB (SE) 2003-04-02 EP disclosed
WO-2002000644-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2002-01-03 WO disclosed