SCHEMBL581155

SCHEMBL581155

CNc1cc(-c2cccnc2Oc2ccc(Nc3nnc(-c4ccccc4)c4c3CCC4)cn2)ccn1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.42
AURKB Q96GD4 2/20 0.42
TPX2 Q9ULW0 2/20 0.42
PDE10A Q9Y233 1/20 0.39
KDR P35968 4/20 0.39
TEK Q02763 4/20 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
SCHEMBL581223 0.89 AURKA (0.53) AURKAAURKBTPX2PDE10A
SCHEMBL580644 0.88 AURKA (0.53) AURKAAURKBTPX2PDE10A
SCHEMBL580947 0.85 AURKB (0.61) AURKAAURKBTPX2KDRTEK
SCHEMBL581058 0.83 AURKB (0.61) AURKAAURKBTPX2KDRTEK
SCHEMBL581142 0.81 AURKA (0.59) AURKAAURKBTPX2PDE10AKDR
SCHEMBL581590 0.81 AURKA (0.46) AURKAAURKBTPX2PDE10AKDR
SCHEMBL581194 0.80 AURKA (0.46) AURKAAURKBTPX2PDE10AKDR
SCHEMBL581191 0.79 AURKA (0.48) AURKAAURKBTPX2PDE10AKDR
SCHEMBL581228 0.78 AURKA (0.46) AURKAAURKBTPX2PDE10AKDR
SCHEMBL580626 0.77 AURKA (0.49) AURKAAURKBTPX2

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