SCHEMBL9954549

SCHEMBL9954549

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 2/20 0.43
NOTUM Q6P988 1/20 0.39
TDP2 O95551 3/20 0.38
NPBWR1 P48145 1/20 0.37
MCHR1 Q99705 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3R1 P27986 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4D Q08499 1/20 0.37
CXCR3 P49682 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
SCHEMBL9954546 0.86 PI4KA (0.44) MAT2ANOTUM
SCHEMBL9954457 0.84 HCAR1 (0.50)
SCHEMBL9954657 0.82 HPD (0.44)
SCHEMBL9954374 0.82 HPD (0.44) MAT2A
SCHEMBL9954100 0.80 SMN1; SMN2 (0.55)
SCHEMBL9953693 0.79 LMNA (0.47) MAT2A
SCHEMBL10517573 0.77 NPC1 (0.46)
SCHEMBL9953965 0.75 POLB (0.41)
SCHEMBL9953129 0.75 POLB (0.41) PIK3CDPIK3R1
SCHEMBL9954122 0.75 ESR2 (0.44)

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