SCHEMBL17033734

SCHEMBL17033734

Fc1ccc(-c2cc(-c3ccc(F)cc3)nc(-n3c4ccccc4c4ccc5c(cc6c7ccccc7c7ccccc7n65)c43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP19A1 P11511 1/20 0.38
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GRM2 Q14416 1/20 0.35
MAPK14 Q16539 2/20 0.33
KDM4E B2RXH2 4/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 1/20 0.33
NR3C1 P04150 1/20 0.33
TP53 P04637 1/20 0.32
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
SQOR Q9Y6N5 1/20 0.31

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
SCHEMBL17033736 0.91 MAPT (0.34) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033424 0.90 MAPT (0.35) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033631 0.87 MAPK1 (0.40) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033755 0.87 TSPO (0.34) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033750 0.86 DHODH (0.38) MAPK1MAPTNPSR1KMT2AMAPK14
SCHEMBL17033824 0.86 MAPK1 (0.41) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033542 0.85 MAPK1 (0.41) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033535 0.84 L3MBTL1 (0.38) MAPK1L3MBTL1MAPTHTTNPSR1
SCHEMBL17033456 0.84 KDM4E (0.30) MAPTALDH1A1HPGDKMT2AKDM4E
SCHEMBL17033769 0.82 DHODH (0.37) MAPK1L3MBTL1MAPTHTTNPSR1

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