SCHEMBL17033408

SCHEMBL17033408

Fc1ccc(-c2cc(-c3ccc(F)cc3)nc(-n3c4ccccc4c4cc5cc6c7ccccc7c7ccccc7n6c5cc43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP19A1 P11511 1/20 0.38
GRM2 Q14416 1/20 0.37
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPK14 Q16539 2/20 0.34
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 2/20 0.33
TP53 P04637 2/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33

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
SCHEMBL17033542 0.96 MAPK1 (0.41) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033406 0.91 L3MBTL1 (0.34) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033609 0.90 KDM4E (0.35) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033502 0.87 L3MBTL1 (0.35) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033483 0.87 L3MBTL1 (0.35) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033420 0.86 NPY5R (0.39) MAPK1MAPTNPSR1ALDH1A1HPGD
SCHEMBL17033618 0.84 KDM4E (0.33) MAPTALDH1A1HPGDKMT2AKDM4E
SCHEMBL17033824 0.84 MAPK1 (0.41) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033683 0.83 ALDH1A1 (0.46) MAPK1MAPTL3MBTL1HTTNPSR1
SCHEMBL17033508 0.83 NPY5R (0.40) MAPK1MAPTNPSR1ALDH1A1HPGD

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed