SCHEMBL18059804

SCHEMBL18059804

Nc1ccc(Oc2ncc(F)cn2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.47
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAP4K4 O95819 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GRM4 Q14833 1/20 0.36
TRPA1 O75762 5/20 0.35
HSPB1 P04792 1/20 0.35
ALOX5AP P20292 2/20 0.35
FEN1 P39748 2/20 0.35
APAF1 O14727 1/20 0.34
KIT P10721 1/20 0.34

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
SCHEMBL18921136 0.87 MAPK14 (0.42) MAPK14MEN1KMT2AMAP4K4GRM4
SCHEMBL20576326 0.83 CYP1A2 (0.47) MAPK14MEN1KMT2AKDM4E
SCHEMBL22534805 0.83 MAPK14 (0.57) MAPK14MEN1KMT2AMAP4K4TRPA1
SCHEMBL25968454 0.79 MEN1 (0.40) MAPK14MEN1KMT2AMAP4K4KDM4E
SCHEMBL30059265 0.79 MEN1 (0.40) MAPK14MEN1KMT2AMAP4K4KDM4E
SCHEMBL30721178 0.74 MAPK14 (0.39) MAPK14ALOX5APFEN1
SCHEMBL10495507 0.73 MEN1 (0.40) MAPK14MEN1KMT2AMAP4K4KDM4E
SCHEMBL27762077 0.73 PDE4B (0.40) MAPK14MEN1KMT2AKDM4ETRPA1
SCHEMBL23146736 0.73 AXL (0.40) MAPK14MEN1KMT2AMAP4K4TRPA1
SCHEMBL29812332 0.73 AXL (0.40) MAPK14MEN1KMT2AMAP4K4TRPA1

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-3070079-A1 Herbicidal fluoromethanesulfonamides BASF SE (DE) 2016-09-21 EP disclosed