SCHEMBL8544631

SCHEMBL8544631

CCO/N=C(\C(=O)NC)c1ccccc1/C(ON)=C(C)/C(=N\OC)c1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.37
HIF1A Q16665 2/20 0.36
BTK Q06187 1/20 0.35
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
RAF1 P04049 1/20 0.34
GCGR P47871 1/20 0.34
KDR P35968 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CHEK2 O96017 1/20 0.33
MAPT P10636 2/20 0.33
LTA4H P09960 1/20 0.33
MAOB P27338 1/20 0.32
PLK4 O00444 1/20 0.32
AURKA O14965 1/20 0.32
MAPK13 O15264 1/20 0.32
JAK2 O60674 1/20 0.32
MAP4K4 O95819 1/20 0.32
ABL1 P00519 1/20 0.32
LCK P06239 1/20 0.32

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
SCHEMBL7494028 0.94 MAPK14 (0.39) MAPK14HIF1ABTKTLR8TLR7
SCHEMBL7466206 0.93 MAPK14 (0.36) MAPK14HIF1ARXFP1LTA4HMAOB
SCHEMBL7470381 0.87 HTR2A (0.34) HIF1ARAF1
SCHEMBL7498151 0.86 HIF1A (0.46) MAPK14HIF1ABTKTLR8TLR7
SCHEMBL7464106 0.86 HIF1A (0.35) HIF1AMAPT
SCHEMBL7467428 0.85 MAOB (0.43) HIF1AMAPTMAOB
SCHEMBL7467262 0.84 MAPK14 (0.39) MAPK14HIF1ABTKTLR8TLR7
SCHEMBL8544633 0.83 HIF1A (0.44) MAPK14HIF1ABTKTLR8TLR7
SCHEMBL8196231 0.83 MAPK14 (0.36) MAPK14HIF1ABTKTLR8TLR7
SCHEMBL7467539 0.82 MAOB (0.46) HIF1AMAOBKDM4E

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-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed