SCHEMBL5494015

SCHEMBL5494015

COc1cc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2cc1OCCCN1CCC[C@@H]1C

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AURKA O14965 20/20 0.87
AURKB Q96GD4 7/20 0.87

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
SCHEMBL5488137 0.94 AURKA (0.77) AURKAAURKB
SCHEMBL5497471 0.94 AURKA (0.77) AURKAAURKB
SCHEMBL5494008 0.93 AURKA (0.86) AURKAAURKB
SCHEMBL4291343 0.93 AURKA (1.00) AURKAAURKB
SCHEMBL3490340 0.93 AURKA (1.00) AURKAAURKB
SCHEMBL4293443 0.91 AURKA (0.96) AURKAAURKB
SCHEMBL3489016 0.91 AURKA (0.82) AURKAAURKB
SCHEMBL3489020 0.90 AURKA (0.81) AURKAAURKB
SCHEMBL4293835 0.90 AURKA (0.88) AURKAAURKB
SCHEMBL3489845 0.90 AURKA (0.85) AURKAAURKB

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
EP-1578755-B1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2007-08-22 EP claimed