O-Xylene

O-Xylene

SCHEMBL19206943

Cc1ccccc1C.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
ACHE P22303 1/20 0.50
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
AGXT P21549 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CA1 P00915 4/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
TACR1 P25103 2/20 0.42
KCNH2 Q12809 1/20 0.42
RXRA P19793 1/20 0.42

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
SCHEMBL9231381 0.87 TSHR (0.62) TSHRMAPTMAPK1TDP1L3MBTL1
SCHEMBL27380 0.87 TSHR (1.00) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL5311581 0.87 TSHR (1.00) TSHRIDO1AGXTALDH1A1CA1
P-Xylene SCHEMBL19206957 0.85 TSHR (0.75) TSHRACHEMAPTMAPK1TDP1
Toluene SCHEMBL19206951 0.85 TSHR (0.75) TSHRACHEMAPTMAPK1TDP1
Propane SCHEMBL11584021 0.84 TSHR (0.83) TSHRMAPTMAPK1TDP1L3MBTL1
Methane SCHEMBL11192510 0.84 TSHR (0.94) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL9491202 0.84 TSHR (0.94) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL1009266 0.84 TSHR (0.94) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL9725547 0.84 TSHR (0.94) TSHRIDO1AGXTALDH1A1CA1

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