SCHEMBL581010

SCHEMBL581010

Clc1cccc(-c2nnc(Nc3ccc(Oc4ncccc4-c4ccnc5[nH]ccc45)cc3)c3ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.53
AURKB Q96GD4 3/20 0.53
TPX2 Q9ULW0 2/20 0.53
NUDT1 P36639 1/20 0.48
TTBK1 Q5TCY1 2/20 0.46
ULK1 O75385 1/20 0.45
RPS6KA5 O75582 1/20 0.45
RPS6KA4 O75676 1/20 0.45
PRKD3 O94806 1/20 0.45
ABL1 P00519 1/20 0.45
FES P07332 1/20 0.45
RET P07949 1/20 0.45
BCR P11274 1/20 0.45
BRAF P15056 1/20 0.45
NQO2 P16083 1/20 0.45
MAP2K2 P36507 1/20 0.45
MAPKAPK2 P49137 1/20 0.45
CLK1 P49759 1/20 0.45
CLK2 P49760 1/20 0.45
CLK3 P49761 1/20 0.45

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
SCHEMBL580677 0.91 AURKA (0.63) AURKAAURKBTPX2TTBK1ULK1
SCHEMBL580118 0.86 AURKA (0.65) AURKAAURKBTPX2TTBK1ULK1
SCHEMBL581902 0.83 AURKA (0.60) AURKAAURKBTPX2ULK1RPS6KA5
SCHEMBL581022 0.81 AURKA (0.53) AURKAAURKBTPX2TTBK1ULK1
SCHEMBL580652 0.81 AURKA (0.69) AURKAAURKBTPX2TTBK1ULK1
SCHEMBL15810152 0.80 AURKB (0.83) AURKAAURKBTPX2ULK1RPS6KA5
SCHEMBL580502 0.78 AURKA (0.67) AURKAAURKBTPX2ULK1RPS6KA5
SCHEMBL581470 0.76 AURKA (0.60) AURKAAURKBTPX2ULK1RPS6KA5
SCHEMBL3700696 0.76 MET (0.55) TTBK1MAPTTTBK2KDR
SCHEMBL581414 0.74 AURKA (0.62) AURKAAURKBTPX2ULK1RPS6KA5

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