SCHEMBL3347682

SCHEMBL3347682

NC(=O)c1ccc(-c2cc(F)cc(F)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
GSK3B P49841 1/20 0.48
PDE4A P27815 2/20 0.45
PDE4B Q07343 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
HPGDS O60760 1/20 0.44
APP P05067 2/20 0.43
TLR8 Q9NR97 1/20 0.43
TLR7 Q9NYK1 1/20 0.43
MAP4K4 O95819 1/20 0.43
CHEK2 O96017 1/20 0.43
ABCB1 P08183 2/20 0.42
PRF1 P14222 1/20 0.41
ABCC1 P33527 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
HSD17B14 Q9BPX1 1/20 0.40
SCN9A Q15858 1/20 0.40
P2RY14 Q15391 1/20 0.40

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
SCHEMBL3620203 0.89 TLR8 (0.44) KMT2AGSK3BPDE4APDE4BPDE4C
SCHEMBL27961477 0.86 KMT2A (0.51) KMT2AGSK3BPDE4APDE4BPDE4C
SCHEMBL4768283 0.85 KMT2A (0.57) KMT2AGSK3BPDE4APDE4BPDE4C
SCHEMBL3626765 0.79 GSK3B (0.48) KMT2AGSK3BPDE4APDE4BPDE4C
SCHEMBL8258906 0.79 MAPK1 (0.54) GSK3BABCB1ABCC1
SCHEMBL319254 0.77 KMT2A (0.58) KMT2AGSK3BGRM2
SCHEMBL30074643 0.77 KMT2A (0.58) KMT2AGSK3BGRM2
SCHEMBL28777569 0.77 GRM5 (0.50) GSK3BHPGDSMAP4K4MKNK1MKNK2
SCHEMBL945743 0.77 GSK3B (0.63) KMT2AGSK3BPDE4APDE4BPDE4C
SCHEMBL3625940 0.77 HPGDS (0.44) GSK3BHPGDSMAP4K4CHEK2ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408767-B1 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2013-07-10 EP claimed
CN-102356079-A Amide derivatives as neuropeptide y5 receptor ligands LUNDBECK & CO AS H 2012-02-15 CN claimed
WO-2010108052-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 2010-09-23 WO claimed
EP-2408767-B1 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2013-07-10 EP disclosed
CN-102356079-A Amide derivatives as neuropeptide y5 receptor ligands LUNDBECK & CO AS H 2012-02-15 CN disclosed
WO-2010108052-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 2010-09-23 WO disclosed
WO-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 WO disclosed