SCHEMBL28076151

SCHEMBL28076151

FC(F)(F)c1cccc(Oc2cccc(Br)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.50
TEAD1 P28347 2/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.45
LRRK2 Q5S007 1/20 0.44
ADORA2A P29274 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
THRB P10828 1/20 0.43
MAPK1 P28482 1/20 0.42
NTRK1 P04629 1/20 0.41
F10 P00742 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 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
SCHEMBL29607042 0.89 MAPT (0.65) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL8773158 0.89 MAPT (0.65) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL8941516 0.86 MAPT (0.59) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL7891911 0.83 TEAD1 (0.54) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL7107314 0.81 MAPT (0.52) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL17764739 0.81 MAPT (0.58) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL3458428 0.81 MAPT (0.58) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL3457474 0.81 MAPT (0.58) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL17772777 0.81 MAPT (0.61) MAPTL3MBTL1TEAD1ALDH1A1POLB
SCHEMBL8507695 0.80 MAPT (0.56) MAPTL3MBTL1TEAD1ALDH1A1POLB

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
CN-105753775-A Synthesis method for 2-bromo-6-(3-(trifluoromethyl)phenoxy)pyridine 常州大学 2016-07-13 CN disclosed
CN-105753775-A Synthesis method for 2-bromo-6-(3-(trifluoromethyl)phenoxy)pyridine 常州大学 2016-07-13 CN disclosed