SCHEMBL28058902

SCHEMBL28058902

Fc1ccc(Br)c(F)c1.Fc1ccccc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 8/20 0.47
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
KDM1A O60341 2/20 0.38
KCNH2 Q12809 2/20 0.38
KDM1B Q8NB78 1/20 0.38
HTT P42858 1/20 0.37
KIF11 P52732 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CA3 P07451 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL14413 0.87
SCHEMBL29350499 0.87
SCHEMBL2913077 0.85 ALDH1A1 (0.48) NFE2L2ALDH1A1CYP1A2CYP2A6KDM1A
Methane SCHEMBL8873095 0.85 ALDH1A1 (0.48) NFE2L2ALDH1A1CYP1A2CYP2A6KDM1A
SCHEMBL29572769 0.84
SCHEMBL153356 0.84
Fluoride SCHEMBL31239586 0.82 HTT (0.43) NFE2L2ALDH1A1HTTCES2CES1
Fluoride SCHEMBL18979129 0.82 HTT (0.43) NFE2L2ALDH1A1HTTCES2CES1
SCHEMBL2707293 0.82
Ammonia Solution, Strong SCHEMBL2165678 0.82

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
CN-105445828-A Thin film capable of improving brightness of brightness enhancement film HEFEI LUCKY SCIENCE & TECH IND CO LTD 2016-03-30 CN disclosed