SCHEMBL8064236

SCHEMBL8064236

NC(=O)Nc1cccc(-c2ccc(F)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 1/20 0.64
KDR P35968 1/20 0.64
CNR1 P21554 4/20 0.62
ALDH1A1 P00352 1/20 0.59
KIF11 P52732 1/20 0.57
MGLL Q99685 3/20 0.57
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
BCL9 O00512 1/20 0.49
CTNNB1 P35222 1/20 0.49
CNR2 P34972 1/20 0.49
HDAC6 Q9UBN7 2/20 0.49
IKBKB O14920 1/20 0.49
JAK2 O60674 1/20 0.49
EIF2AK2 P19525 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
FFAR1 O14842 1/20 0.48
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
PNPLA2 Q96AD5 1/20 0.47

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
SCHEMBL4082541 0.86 MGLL (0.72) CNR1KIF11MGLLHDAC6
SCHEMBL30164935 0.86 MGLL (0.72) CNR1KIF11MGLLHDAC6
SCHEMBL13749770 0.83 KIF11 (0.69) FGFR3KDRCNR1KIF11MGLL
SCHEMBL10310335 0.83 CNR1 (0.55) FGFR3KDRCNR1MGLLMEN1
SCHEMBL4091879 0.83 CNR1 (0.71) CNR1KIF11MGLLCNR2
SCHEMBL5425703 0.83 KIF11 (0.74) ALDH1A1KIF11MGLLMEN1KMT2A
SCHEMBL28047630 0.82 CFD (0.57) FGFR3KDRCNR1KIF11MGLL
SCHEMBL28047623 0.81 MGLL (0.51) FGFR3KDRCNR1ALDH1A1KIF11
SCHEMBL167713 0.80 MEN1 (0.67) ALDH1A1MEN1KMT2ATDP1KCNK3
SCHEMBL11907480 0.80 FGFR3 (1.00) FGFR3KDR

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
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 WO disclosed