SCHEMBL7096570

SCHEMBL7096570

Nc1nc2ccccc2c2c1ncn2OC(=O)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.53
ADORA2A P29274 2/20 0.49
NUDT1 P36639 2/20 0.49
PDE4D Q08499 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
HRH2 P25021 1/20 0.49
ADRA1D P25100 1/20 0.49
HTR2A P28223 1/20 0.49
ADRA1A P35348 1/20 0.49
HTR2B P41595 1/20 0.49
KCNH2 Q12809 1/20 0.49
ADORA3 P0DMS8 1/20 0.38
ADORA1 P30542 1/20 0.38
TLR8 Q9NR97 8/20 0.38
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36

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
SCHEMBL2706302 0.77 TLR7 (0.58) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL2706297 0.76 TLR7 (0.58) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL2708373 0.74 TLR7 (0.57) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL2707594 0.74 TLR7 (0.61) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL5617005 0.73 TLR7 (0.70) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL1486447 0.73 TLR7 (0.53) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL6030934 0.72 TLR7 (0.59) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL5748067 0.72 TLR7 (0.53) TLR7ADORA2ANUDT1PDE4DLMNA
SCHEMBL3937093 0.72 KDM4E (0.37) TLR7LMNAADORA3
SCHEMBL22803659 0.71 TLR7 (0.73) TLR7ADORA2ANUDT1PDE4DLMNA

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-1341789-A2 ARYL ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-10 EP disclosed
WO-2002046189-A2 ARYL ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-06-13 WO disclosed