P-Xylene

P-Xylene

SCHEMBL28247604

Cc1ccc(C)cc1.OCOCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.50
TDP1 Q9NUW8 2/20 0.50
GAA P10253 1/20 0.42
AGXT P21549 2/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
CA2 P00918 2/20 0.39
IDO1 P14902 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
ORAI1 Q96D31 1/20 0.39
ORAI2 Q96SN7 1/20 0.39
ORAI3 Q9BRQ5 1/20 0.39
TRPV6 Q9H1D0 1/20 0.39
CA1 P00915 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
WDR5 P61964 1/20 0.38

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
SCHEMBL8233351 0.82 AGXT (0.54) ACHEGAAAGXTALDH1A1CA2
P-Xylene SCHEMBL18334385 0.77 TSHR (0.56) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL27968200 0.77 TSHR (0.56) ACHETDP1GAAALDH1A1LMNA
SCHEMBL13385735 0.77 WDR5 (0.46) ACHETDP1GAALMNAWDR5
P-Xylene SCHEMBL28856424 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL28321095 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL28248643 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL9720606 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL4257237 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA
P-Xylene SCHEMBL109385 0.76 ACHE (0.61) ACHETDP1GAAALDH1A1LMNA

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-104650685-B Delustring hides hot coating composition and has used the coating film-forming methods of the composition 关西涂料株式会社 2018-10-19 CN disclosed