SCHEMBL5828485

SCHEMBL5828485

COc1cc2c(/N=C(/NCCO)Nc3c(C)cccc3Cl)ncnc2cc1OCC1CCN(C)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.53
KDR P35968 8/20 0.49
SRC P12931 2/20 0.49
CSK P41240 1/20 0.49
TEK Q02763 1/20 0.49
FGFR1 P11362 4/20 0.48
FLT1 P17948 4/20 0.48
FLT4 P35916 4/20 0.48
RET P07949 1/20 0.47
KIF5B P33176 1/20 0.47

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
SCHEMBL5828489 1.00 EGFR (0.53) EGFRKDRSRCCSKTEK
SCHEMBL5829124 0.88 KDR (0.51) EGFRKDRSRCCSKTEK
SCHEMBL5829126 0.88 KDR (0.51) EGFRKDRSRCCSKTEK
SCHEMBL5827935 0.85 EGFR (0.50) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5827933 0.85 EGFR (0.50) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5828894 0.85 EGFR (0.52) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5828900 0.85 EGFR (0.52) EGFRKDRFGFR1FLT1FLT4
SCHEMBL6980090 0.84 EGFR (0.60) EGFRKDRSRCCSKTEK
SCHEMBL5827926 0.84 RAF1 (0.47) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5827928 0.84 RAF1 (0.47) EGFRKDRFGFR1FLT1FLT4

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
US-7001904-B1 Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases ASTRAZENECA AB (SE) 2006-02-21 US claimed
US-7001904-B1 Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases ASTRAZENECA AB (SE) 2006-02-21 US disclosed
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