M-Xylene

M-Xylene

SCHEMBL28071717

C=C(C(=O)O)C(=O)O.Cc1cccc(C)c1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.55
▸ PARP1 P09874 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CTBP2 P56545 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ KCNK3 O14649 2/20 0.41
▸ KCNK9 Q9NPC2 2/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ RXFP1 Q9HBX9 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
M-Xylene SCHEMBL18496754 0.86 ACHE (0.55) ACHEPARP1SMN1; SMN2CTBP2LMNA
M-Xylene SCHEMBL27141133 0.86 ACHE (0.55) ACHEPARP1SMN1; SMN2CTBP2LMNA
Toluene SCHEMBL28180802 0.86 LMNA (0.55) ACHESMN1; SMN2LMNAPOLBMEN1
M-Xylene SCHEMBL31229728 0.80 ACHE (0.67) ACHEPARP1SMN1; SMN2CTBP2LMNA
M-Xylene SCHEMBL10427453 0.80 ACHE (0.86) ACHEPARP1SMN1; SMN2LMNAHDAC8
M-Xylene SCHEMBL11703686 0.78 ACHE (0.63) ACHEPARP1SMN1; SMN2CTBP2LMNA
M-Xylene SCHEMBL27651227 0.78 PARP1 (0.64) ACHEPARP1SMN1; SMN2CTBP2LMNA
M-Xylene SCHEMBL27785615 0.78 ACHE (0.63) ACHEPARP1SMN1; SMN2CTBP2LMNA
M-Xylene SCHEMBL31348956 0.78 ACHE (0.63) ACHEPARP1SMN1; SMN2CTBP2LMNA
Methacrylic Acid SCHEMBL29876675 0.78 ACHE (0.44) ACHEPARP1SMN1; SMN2CTBP2LMNA

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-103649131-B Solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefin polymer TOHO TITANIUM CO.,LTD. (JP) 2016-05-25 — — CN disclosed
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