P-Xylene

P-Xylene

SCHEMBL28217850

Cc1cc(Cl)c(C)cc1Cl.Cc1ccc(C)c(F)c1.Cc1ccc(C)cc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.42
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACHE P22303 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
CD44 P16070 1/20 0.37
KCNQ3 O43525 1/20 0.36
KCNQ2 O43526 1/20 0.36
KCNE1 P15382 1/20 0.36
KCNQ1 P51787 1/20 0.36
KCNQ5 Q9NR82 1/20 0.36

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
P-Xylene SCHEMBL28885091 0.87 ACHE (0.48) NFE2L2HDAC1HDAC6ACHEALDH1A1
SCHEMBL30167752 0.84
SCHEMBL30527 0.84
Benzene SCHEMBL28448554 0.80 ACHE (0.48) NFE2L2HDAC1HDAC6MEN1NPC1
Nitrogen SCHEMBL27314581 0.80 HDAC1 (0.45) NFE2L2HDAC1HDAC6MEN1LMNA
Methoxymethane SCHEMBL27503637 0.78 HDAC1 (0.44) NFE2L2HDAC1HDAC6CYP3A4KMT2A
SCHEMBL9918976 0.77 CD44 (0.46) CYP3A4NPC1LMNARAB9ASMN1; SMN2
SCHEMBL170493 0.75
SCHEMBL89325 0.74
P-Xylene SCHEMBL28217877 0.73 CYP3A4 (0.38) CYP3A4MEN1LMNARAB9AKMT2A

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-108101027-B Large-area CVD graphene doping transfer method 重庆墨希科技有限公司 2020-01-31 CN disclosed
CN-108101027-A Large area CVD graphenes adulterate transfer method 重庆墨希科技有限公司 2018-06-01 CN disclosed