SCHEMBL16628722

SCHEMBL16628722

Fc1ccc(CN2C=Cc3[nH]c(-c4cccc(F)c4F)nc3C2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.36
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
MAPK14 Q16539 1/20 0.31
GRIN1 Q05586 1/20 0.31
BRD4 O60885 1/20 0.31
P2RX7 Q99572 1/20 0.30
GRK6 P43250 1/20 0.30
KCNK3 O14649 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL1960354 0.88 KDM4E (0.36) KDM4ESMN1; SMN2DRD2MAPK14BRD4
SCHEMBL2343626 0.87 KDM4E (0.36) KDM4ESMN1; SMN2DRD2DRD1MAPK14
SCHEMBL1961173 0.85 KDM4E (0.35) KDM4ESMN1; SMN2
SCHEMBL1961792 0.85 KCNK3 (0.38) KDM4ESMN1; SMN2MAPK14KCNK3
SCHEMBL3180975 0.80 GRIN2B (0.37) GRIN2BSMN1; SMN2GRK6
SCHEMBL3187760 0.78 GRIN2B (0.37) GRIN2BGRK6
SCHEMBL3542557 0.78 GRIN2B (0.39) GRIN2BGRIN1GRK6
SCHEMBL3191507 0.76 HCRTR1 (0.37) GRIN2B
SCHEMBL1958077 0.75 GAA (0.43) SMN1; SMN2MAPK14P2RX7
SCHEMBL1959936 0.75 ADORA2B (0.32) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161273-B1 Imidazo[4,5-c]pyridine compounds and methods of antiviral treatment LEUVEN K U RES & DEV (BE) 2015-04-15 EP claimed