P-Xylene

P-Xylene

SCHEMBL19206957

Cc1ccc(C)cc1.c1ccc(COCc2ccccc2)cc1

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.75
KCNH2 Q12809 1/20 0.57
AGXT P21549 3/20 0.50
HTT P42858 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
IDO1 P14902 1/20 0.48
LMNA P02545 2/20 0.48
ALOX12 P18054 1/20 0.48
ACHE P22303 1/20 0.48
AR P10275 1/20 0.48
POLB P06746 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TACR1 P25103 1/20 0.44
CA1 P00915 2/20 0.44

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
SCHEMBL257896 0.98 TSHR (0.71) TSHRKCNH2AGXTHTTCYP2C19
Toluene SCHEMBL19206951 0.95 TSHR (0.75) TSHRKCNH2AGXTHTTCYP2C19
SCHEMBL3161372 0.87 AGXT (0.64) TSHRKCNH2AGXTTDP1IDO1
SCHEMBL9617939 0.87 AGXT (0.64) TSHRKCNH2AGXTTDP1IDO1
SCHEMBL27380 0.87 TSHR (1.00) TSHRAGXTCYP2C19IDO1LMNA
SCHEMBL5311581 0.87 TSHR (1.00) TSHRAGXTCYP2C19IDO1LMNA
SCHEMBL14378835 0.86 HPGD (0.61) TSHRKCNH2AGXTHTTCYP2C19
O-Xylene SCHEMBL19206943 0.85 TSHR (0.75) TSHRKCNH2AGXTMAPTMAPK1
SCHEMBL24131104 0.84 TSHR (0.54) TSHRKCNH2AGXTCYP2C19MAPT
Propane SCHEMBL11584021 0.84 TSHR (0.83) TSHRAGXTMAPTMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3496174-B1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME SUMITOMO CHEMICAL CO (JP) 2024-06-12 EP disclosed
CN-107109090-B Ink composition and photoelectric conversion element produced using same 住友化学株式会社 2021-10-08 CN disclosed
EP-3496174-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME Sumitomo Chemical Company, Ltd. (JP) 2019-06-12 EP disclosed
EP-3219765-B1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
EP-3219765-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION ELEMENT PRODUCED USING SAME Sumitomo Chemical Company, Ltd. (JP) 2017-09-20 EP disclosed
US-20170237012-A1 INK COMPOSITION AND PHOTOELECTRIC CONVERSION DEVICE PRODUCED USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-17 US disclosed