SCHEMBL14079359

SCHEMBL14079359

COC(=O)c1ccccc1Nc1nc(Nc2cccc(C)c2)nc(Nc2ccccc2C(=O)C=O)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 6/20 0.50
AURKA O14965 2/20 0.50
MAPK8 P45983 1/20 0.50
AURKB Q96GD4 1/20 0.50
MAPT P10636 2/20 0.49
ALOX15 P16050 1/20 0.49
KDM4E B2RXH2 4/20 0.44
GLA P06280 1/20 0.44
POLB P06746 2/20 0.43
ATM Q13315 1/20 0.43
KCNH3 Q9ULD8 1/20 0.43
CDC7 O00311 1/20 0.43
DAPK3 O43293 1/20 0.43
PRKD3 O94806 1/20 0.43
PIM1 P11309 1/20 0.43
CDK2 P24941 1/20 0.43
FLT3 P36888 1/20 0.43
CSNK1A1 P48729 1/20 0.43
GSK3B P49841 1/20 0.43
CDK7 P50613 1/20 0.43

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
SCHEMBL4544791 0.92 MAPT (0.57) PTK2AURKAMAPK8AURKBMAPT
SCHEMBL14079358 0.89 MAPT (0.63) PTK2AURKAMAPK8MAPTALOX15
SCHEMBL14079362 0.86 PTK2 (0.46) PTK2AURKAMAPTALOX15KDM4E
SCHEMBL14079360 0.84 MAPT (0.49) PTK2AURKAMAPTALOX15KDM4E
SCHEMBL7852387 0.82 MAPT (0.71) AURKAMAPK8AURKBMAPTALOX15
SCHEMBL4544815 0.82 CDC25B (0.57) AURKAMAPK8AURKBMAPTKDM4E
SCHEMBL4544793 0.80 MAPT (0.77) PTK2AURKAMAPK8MAPTALOX15
SCHEMBL4544804 0.77 PTK2 (0.52) PTK2AURKAMAPTALOX15KDM4E
SCHEMBL4544820 0.75 KDM4E (0.60) MAPTKDM4EPOLBKCNH3NFKB1
SCHEMBL4544795 0.74 MAPT (0.58) PTK2AURKAMAPTALOX15KDM4E

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
US-20080192192-A1 Optical film and polarizing plate FUJIFILM CORPORATION (JP) 2008-08-14 US disclosed