SCHEMBL461789

SCHEMBL461789

COc1ccc(-c2cc(-c3cccc4[nH]ccc34)cc3[nH]ncc23)nc1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.48
PIK3CB P42338 5/20 0.48
PIM1 P11309 2/20 0.48
GSK3B P49841 2/20 0.48
BRD4 O60885 2/20 0.47
PIK3CG P48736 3/20 0.47
PIK3CA P42336 2/20 0.47
BTK Q06187 4/20 0.38
LCK P06239 3/20 0.38
TEC P42680 3/20 0.38
BMX P51813 3/20 0.38
BLK P51451 2/20 0.37
ITK Q08881 2/20 0.37
LYN P07948 1/20 0.37
HCK P08631 1/20 0.37
FGR P09769 1/20 0.37
SRC P12931 1/20 0.37
FRK P42685 1/20 0.37
LIMK1 P53667 1/20 0.37
ACVR1 Q04771 1/20 0.37

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
SCHEMBL459116 0.78 PIK3CD (0.59) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1119167 0.77 PIK3CD (0.56) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL463054 0.77 PIK3CD (0.51) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1430757 0.76 PIK3CD (0.49) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1431305 0.75 PIK3CD (0.55) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1431437 0.74 PIK3CD (0.55) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1252585 0.74 PIK3CD (0.70) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL1779660 0.73 PIK3CD (0.63) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL2166230 0.73 PIK3CD (0.64) PIK3CDPIK3CBPIM1GSK3BBRD4
SCHEMBL2165902 0.72 PIK3CD (0.68) PIK3CDPIK3CBPIM1GSK3BBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2613781-A1 INDAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF INFLUENZA VIRUS INFECTION GlaxoSmithKline Intellectual Property Development Limited (GB) 2013-07-17 EP disclosed
WO-2012032065-A1 INDAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF INFLUENZA VIRUS INFECTION GLAXO GROUP LIMITED (GB) 2012-03-15 WO disclosed