SCHEMBL6823586

SCHEMBL6823586

COc1cc(Nc2ncnc3cc(O)cc(OC(C)C)c23)c(Cl)cn1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 15/20 0.61
EGFR P00533 1/20 0.48
KDR P35968 16/20 0.45
RET P07949 3/20 0.43
KIF5B P33176 2/20 0.43
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39

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
SCHEMBL3280052 0.84 SRC (0.67) SRCEGFRKDRRETKIF5B
SCHEMBL6922194 0.84 SRC (0.75) SRCEGFRKDR
SCHEMBL6819711 0.84 SRC (0.72) SRCEGFRKDR
SCHEMBL6829839 0.82 SRC (0.60) SRCEGFRKDRRETKIF5B
SCHEMBL6826353 0.82 SRC (0.60) SRCEGFRKDRMKNK1MKNK2
SCHEMBL6831400 0.82 SRC (0.64) SRCEGFRKDRRETKIF5B
SCHEMBL6819634 0.82 SRC (0.61) SRCEGFRKDRMKNK1MKNK2
SCHEMBL6823529 0.81 SRC (0.62) SRCEGFRKDR
SCHEMBL6823799 0.79 EGFR (0.52) SRCEGFRKDRRETKIF5B
SCHEMBL6823949 0.76 SRC (0.77) SRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004056812-A1 4- (PYRIDIN-4-YLAMINO) -QUINAZOLINE DERIVATIVES AS ANTI-TUMOR AGENTS ASTRAZENECA AB (SE) 2004-07-08 WO disclosed