P-Xylene

P-Xylene

SCHEMBL28115019

CC(=O)CC(C)C.CCC(C)=O.Cc1ccc(C)cc1.Cc1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
ACHE P22303 2/20 0.46
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SLC25A5 P05141 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 3/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
HPGD P15428 2/20 0.39
STAT3 P40763 1/20 0.39
POLB P06746 1/20 0.39

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
Methyl Isobutyl Ketone SCHEMBL8727203 0.98 ALDH1A1 (0.52) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
O-Xylene SCHEMBL9644431 0.93 ALDH1A1 (0.47) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Methyl Isobutyl Ketone SCHEMBL163328 0.93 ALDH1A1 (0.58) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Toluene SCHEMBL9504618 0.89 ACHE (0.54) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Toluene SCHEMBL28077055 0.89 ACHE (0.54) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Methyl Isobutyl Ketone SCHEMBL9328768 0.89 ALDH1A1 (0.54) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
P-Xylene SCHEMBL28174939 0.88 ALDH1A1 (0.48) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Methyl Isobutyl Ketone SCHEMBL11127111 0.88 ALDH1A1 (0.48) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
O-Xylene SCHEMBL28124110 0.88 KDM4E (0.44) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT
Methyl Isobutyl Ketone SCHEMBL10487290 0.87 ACHE (0.56) TDP1ALDH1A1SMN1; SMN2KDM4EMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153909-A Composite material, method of manufacturing the same and article comprising the composite material 罗杰斯公司 2019-01-04 CN disclosed
CN-107771125-A Circuit materials and articles formed therefrom 罗杰斯公司 2018-03-06 CN disclosed
CN-106255721-A Heat-conductive composite material and manufacture method thereof and comprise the goods of described composite 罗杰斯公司 2016-12-21 CN disclosed