SCHEMBL9953665

SCHEMBL9953665

Nc1nc2ccc(I)cc2c(=O)n1-c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.45
HPD P32754 2/20 0.44
PI4KA P42356 9/20 0.43
PIK3CG P48736 7/20 0.42
PIK3CD O00329 1/20 0.41

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
SCHEMBL9954423 0.88 POLB (0.41) TGM2PI4KAPIK3CGPIK3CD
SCHEMBL9953324 0.87 HCAR1 (0.50) PI4KAPIK3CG
SCHEMBL9954651 0.86 POLB (0.53) HPDPI4KAPIK3CG
SCHEMBL9954657 0.85 HPD (0.44) TGM2HPD
SCHEMBL9955586 0.85 HPD (0.44) HPDPI4KAPIK3CG
SCHEMBL9955061 0.84 PIK3CG (0.48) PI4KAPIK3CGPIK3CD
SCHEMBL9953795 0.83 SMN1; SMN2 (0.55) HPDPI4KAPIK3CG
SCHEMBL9954505 0.82 PDE7A (0.45) PI4KA
SCHEMBL9954546 0.82 PI4KA (0.44) PI4KAPIK3CG
SCHEMBL9952904 0.80 GLA (0.51) 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