SCHEMBL9954546

SCHEMBL9954546

N#Cc1cccc(-n2c(N)nc3ccc(I)cc3c2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 3/20 0.44
PIK3CG P48736 2/20 0.44
RPS6KB1 P23443 1/20 0.40
MAT2A P31153 1/20 0.39
NOTUM Q6P988 1/20 0.39
NSD2 O96028 1/20 0.38
JAK2 O60674 1/20 0.38
PRKD3 O94806 1/20 0.38
ABL1 P00519 1/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
LCK P06239 1/20 0.38
CDK1 P06493 1/20 0.38
CSF1R P07333 1/20 0.38
LYN P07948 1/20 0.38
RET P07949 1/20 0.38
KIT P10721 1/20 0.38
FGFR1 P11362 1/20 0.38
FER P16591 1/20 0.38
FLT1 P17948 1/20 0.38

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
SCHEMBL9954549 0.86 MAT2A (0.43) MAT2ANOTUM
SCHEMBL9953324 0.84 HCAR1 (0.50) PI4KAPIK3CG
SCHEMBL9953665 0.82 TGM2 (0.45) PI4KAPIK3CG
SCHEMBL9955586 0.82 HPD (0.44) PI4KAPIK3CG
SCHEMBL9953795 0.80 SMN1; SMN2 (0.55) PI4KAPIK3CG
SCHEMBL9955061 0.79 PIK3CG (0.48) PI4KAPIK3CGLCKLYNFLT3
SCHEMBL9954094 0.75 HCAR1 (0.51) PI4KAPIK3CG
SCHEMBL9954423 0.75 POLB (0.41) PI4KAPIK3CG
SCHEMBL9953800 0.75 POLB (0.41) PI4KAPIK3CG
SCHEMBL9954651 0.75 POLB (0.53) PI4KAPIK3CG

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
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed