O-Xylene

O-Xylene

SCHEMBL27264239

CCN.Cc1ccccc1C

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.67
ACHE P22303 2/20 0.67
TAAR1 Q96RJ0 1/20 0.52
CYP3A4 P08684 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 4/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
CYP1A2 P05177 2/20 0.40
CYP2A6 P11509 2/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
CD44 P16070 1/20 0.39
TP53 P04637 1/20 0.38
LOXL2 Q9Y4K0 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
O-Xylene SCHEMBL27846991 0.97 ACHE (0.62) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL28173563 0.88 ACHE (0.59) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL28238793 0.87 ACHE (0.67) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL28897630 0.83 TSHR (0.71) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL27256493 0.82 TSHR (0.83) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL16537456 0.82 TSHR (0.83) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL2854068 0.82
O-Xylene SCHEMBL11034038 0.82 TSHR (1.00) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL11035539 0.82 TSHR (1.00) TSHRACHETAAR1CYP3A4TDP1
O-Xylene SCHEMBL8216257 0.82 TSHR (1.00) TSHRACHETAAR1CYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101115562-A Packing material for ion chromatography SHOWA DENKO KK (JP) 2008-01-30 CN claimed
CN-111848494-B Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2023-08-01 CN disclosed
CN-104136474-A Non-aqueous liquid coating composition AKZO NOBEL COATINGS INT BV 2014-11-05 CN disclosed
CN-101133005-B Method for purifying radiolabeled products using solid carrier scavengers HAMMERSMITH IMANET LTD 2012-11-14 CN disclosed
CN-102516003-A Methods for the purification of radiolabelled products using a solid-support scavenger HAMMERSMITH IMANET LTD 2012-06-27 CN disclosed
CN-101133005-A Method for purifying radiolabeled products using solid carrier scavengers HAMMERSMITH IMANET LTD (GB) 2008-02-27 CN disclosed
CN-101115562-A Packing material for ion chromatography SHOWA DENKO KK (JP) 2008-01-30 CN disclosed
CN-1056365-C Process for the continuous preparation of diaryl carbonates BAYER AG (DE) 2000-09-13 CN disclosed
CN-1041839-C Controllec film build epoxy coatings applied by cathodic electrodeposition DOW CHEMICAL CO (US) 1999-01-27 CN disclosed
CN-1112107-A Process for the continuous preparation of diaryl carbonates BAYER AG (DE) 1995-11-22 CN disclosed
CN-1021449-C Method for preparing epoxy cationic resin from epoxy resin composition DOW CHEMICAL CO (US) 1993-06-30 CN disclosed
CN-1020720-C HYDROFORMYLATION USING LOW VOLATILE ORGANIC SOLUBLE PHOSPHINE LIGANDS UNION CARBIDE CORP (US) 1993-05-19 CN disclosed
CN-1016430-B Process for preparing cationically improved epoxy resin compositions DOW CHEMICAL CO (US) 1992-04-29 CN disclosed
CN-1053441-A The controlling diaphragm that the epoxy coating that is applied by cathode electrodeposition constitutes DOW CHEMICAL CO (US) 1991-07-31 CN disclosed
CN-1052320-A Electrodeposition coating composition of the Resins, epoxy that the cation type has improved and uses thereof DOW CHEMICAL CO (US) 1991-06-19 CN disclosed
CN-87106228-A Controllable film-forming epoxy coating for cathodic electrocoating 1988-08-10 CN disclosed
CN-87106486-A Crosslinking agents for control films made of epoxy coatings applied by cathodic electrodeposition 1988-06-29 CN disclosed
CN-87104910-A Cationic improved epoxy resin compositions 1988-05-04 CN disclosed
CN-87105466-A Carbonylation process using low volatility/organic soluble phosphine ligands 1988-02-03 CN disclosed