SCHEMBL6525975

SCHEMBL6525975

O=C(Cc1cc(Nc2ncnc3cc(OCCCN4CCCC4CCO)ccc23)n[nH]1)Nc1cccc(F)c1F

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 19/20 0.90
AURKB Q96GD4 7/20 0.72
PDGFRB P09619 3/20 0.53
KIT P10721 3/20 0.53
PDGFRA P16234 3/20 0.53
CSF1R P07333 2/20 0.53
RIPK2 O43353 2/20 0.53
EGFR P00533 2/20 0.53
LCK P06239 2/20 0.53
LYN P07948 2/20 0.53
RET P07949 2/20 0.53
HCK P08631 2/20 0.53
CSNK2A2 P19784 2/20 0.53
KDR P35968 2/20 0.53
FLT3 P36888 2/20 0.53
MST1R Q04912 2/20 0.53
MAP2K5 Q13163 2/20 0.53
AURKC Q9UQB9 2/20 0.53
MAP4K5 Q9Y4K4 2/20 0.53
PLK4 O00444 1/20 0.53

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
SCHEMBL3489346 1.00 AURKA (0.90) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL3490173 0.95 AURKA (1.00) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL3488987 0.95 AURKA (1.00) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL3489265 0.93 AURKA (0.96) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL3488850 0.93 AURKA (0.96) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL3488710 0.93 AURKA (0.84) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL5494422 0.91 AURKA (0.86) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL5494428 0.91 AURKA (0.86) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL5488366 0.91 AURKA (0.86) AURKAAURKBPDGFRBKITPDGFRA
SCHEMBL5488372 0.91 AURKA (0.86) AURKAAURKBPDGFRBKITPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578755-A1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AstraZeneca AB (SE) 2005-09-28 EP disclosed
WO-2004058781-A1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2004-07-15 WO disclosed