SCHEMBL4686372

SCHEMBL4686372

COc1cc2c(NC(=S)Nc3c(C)cccc3Cl)ncnc2cc1OCC1CCN(C)CC1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.64
KDR P35968 6/20 0.59
SRC P12931 2/20 0.59
FGFR1 P11362 3/20 0.59
FLT1 P17948 3/20 0.59
FLT4 P35916 3/20 0.59
CSK P41240 1/20 0.59
TEK Q02763 1/20 0.59
RET P07949 1/20 0.57
KIF5B P33176 1/20 0.57

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
SCHEMBL4689388 0.95 EGFR (0.68) EGFRKDRSRCFGFR1FLT1
SCHEMBL4427825 0.94 EGFR (0.62) EGFRKDRSRCFGFR1FLT1
SCHEMBL5498170 0.91 EGFR (0.64) EGFRKDRSRCFGFR1FLT1
SCHEMBL4691264 0.88 EGFR (0.61) EGFRKDRSRCFGFR1FLT1
SCHEMBL4689353 0.88 KDR (0.55) EGFRKDRFGFR1FLT1FLT4
SCHEMBL6980090 0.87 EGFR (0.60) EGFRKDRSRCFGFR1FLT1
SCHEMBL4690075 0.87 EGFR (0.64) EGFRKDRSRCFGFR1FLT1
SCHEMBL4689357 0.87 KDR (0.67) EGFRKDRSRCFGFR1FLT1
SCHEMBL4693103 0.86 EGFR (0.58) EGFRKDRFGFR1FLT1FLT4
SCHEMBL5828619 0.86 EGFR (0.58) EGFRKDRSRCFGFR1FLT1

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-B1 GUANIDINE DERIVATIVES OF QUINAZOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2008-11-05 EP disclosed
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