SCHEMBL4692095

SCHEMBL4692095

COCCN1CCC(COc2cc3ncnc(NC(=S)Nc4c(C)cccc4C)c3cc2OC)CC1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.52
KDR P35968 6/20 0.51
RET P07949 1/20 0.51
KIF5B P33176 1/20 0.51
FGFR1 P11362 4/20 0.49
FLT1 P17948 4/20 0.49
FLT4 P35916 4/20 0.49

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
SCHEMBL4427825 0.91 EGFR (0.62) EGFRKDRRETKIF5BFGFR1
SCHEMBL4689353 0.89 KDR (0.55) EGFRKDRRETKIF5BFGFR1
SCHEMBL4693103 0.86 EGFR (0.58) EGFRKDRRETKIF5BFGFR1
SCHEMBL4689828 0.86 RET (0.60) EGFRKDRRETKIF5BFGFR1
SCHEMBL4686372 0.86 EGFR (0.64) EGFRKDRRETKIF5BFGFR1
SCHEMBL4690872 0.85 EGFR (0.58) EGFRKDRRETKIF5BFGFR1
SCHEMBL4693023 0.84 RET (0.61) EGFRKDRRETKIF5BFGFR1
SCHEMBL5828675 0.83 EPHA2 (0.53) EGFRKDRRETKIF5BFGFR1
SCHEMBL5828725 0.83 FLT1 (0.62) EGFRKDRRETKIF5BFGFR1
SCHEMBL5832489 0.83 FLT1 (0.62) EGFRKDRRETKIF5BFGFR1

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