SCHEMBL580218

SCHEMBL580218

Cc1csc(-c2cc(C)c(Nc3ccc(Oc4ncccc4-c4ccncc4)cc3)nn2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.56
ULK1 O75385 1/20 0.56
RPS6KA5 O75582 1/20 0.56
RPS6KA4 O75676 1/20 0.56
PRKD3 O94806 1/20 0.56
ABL1 P00519 1/20 0.56
FES P07332 1/20 0.56
RET P07949 1/20 0.56
BCR P11274 1/20 0.56
BRAF P15056 1/20 0.56
NQO2 P16083 1/20 0.56
MAP2K2 P36507 1/20 0.56
MAPKAPK2 P49137 1/20 0.56
CLK1 P49759 1/20 0.56
CLK2 P49760 1/20 0.56
CLK3 P49761 1/20 0.56
MAP2K1 Q02750 1/20 0.56
TOP2B Q02880 1/20 0.56
PRKCD Q05655 1/20 0.56
DDR1 Q08345 1/20 0.56

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
SCHEMBL580721 0.91 AURKA (0.59) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL580530 0.85 PDE10A (0.53) AURKAAURKBPDE10A
SCHEMBL581766 0.84 AURKA (0.75) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL580811 0.78 AURKA (0.50) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL581039 0.77 AURKA (0.50) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL580671 0.77 AURKA (0.77) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL580667 0.76 AURKA (0.78) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL581286 0.75 AURKA (0.59) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL581877 0.75 PDE10A (0.50) PDE10A
SCHEMBL581376 0.74 AURKA (0.71) AURKAULK1RPS6KA5RPS6KA4PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984353-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2015-12-30 EP disclosed
EP-2418209-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-06-25 EP disclosed
EP-2418209-A1 Aurora kinase modulators and method of use Amgen Inc. (US) 2012-02-15 EP disclosed