O-Xylene

O-Xylene

SCHEMBL1443689

CC#N.Cc1ccccc1C

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.67
ACHE P22303 3/20 0.67
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
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 3/20 0.40
CYP2A6 P11509 2/20 0.40
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MGLL Q99685 1/20 0.37
LMNA P02545 1/20 0.37

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 SCHEMBL27496500 0.87 TSHR (0.67) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL27492161 0.86 TSHR (0.91) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL22719990 0.86 TSHR (0.91) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL11875587 0.86
O-Xylene SCHEMBL30184332 0.86
O-Xylene SCHEMBL8556899 0.84 TSHR (0.62) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL9818029 0.83 TSHR (0.46) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL10999223 0.82 TSHR (0.83) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL28002440 0.82 TSHR (0.83) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL27520441 0.82 TSHR (0.83) TSHRACHEALDH1A1CA1CA2

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9827559-B2 Method for preparing nano metal/metal oxide loaded molecular sieve catalyst Changzhou University (CN) 2017-11-28 US claimed
US-20160074849-A1 METHOD FOR PREPARING NANO METAL/METAL OXIDE LOADED MOLECULAR SIEVE CATALYST Changzhou University 2016-03-17 US claimed
EP-2475663-A2 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES Actavis Group Ptc Ehf (IS) 2012-07-18 EP claimed
US-20120164188-A1 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES ACTAVIS GROUP PTC EHF (IS) 2012-06-28 US claimed
WO-2011030224-A2 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES ACTAVIS GROUP PTC EHF (IS) 2011-03-17 WO claimed
WO-2024019137-A1 PRODUCTION METHOD OF OLIGONUCLEOTIDE 住友化学株式会社 2024-01-25 WO disclosed
CN-107250283-B Compounds and compositions containing the same 住友化学株式会社 2019-09-10 CN disclosed
CN-107193072-B Elliptical polarization plate 住友化学株式会社 2018-08-28 CN disclosed
US-9827559-B2 Method for preparing nano metal/metal oxide loaded molecular sieve catalyst Changzhou University (CN) 2017-11-28 US disclosed
CN-107250283-A compounds and compositions containing the same 住友化学株式会社 2017-10-13 CN disclosed
CN-107250322-A Composition comprising a metal oxide and a metal oxide 住友化学株式会社 2017-10-13 CN disclosed
CN-107193072-A Elliptical polarization plate 住友化学株式会社 2017-09-22 CN disclosed
CN-1324359-A Tricyclic carboxamides SMITHKLINE BEECHAM PLC (GB) 2001-11-28 CN disclosed
CN-1319081-A Method for pressureless production of alpha, alpha-dimethylphenyl acetic acid from alpha, alpha-dimethyl benzyl cyanide AVENTIS PHARMA GMBH (DE) 2001-10-24 CN disclosed
CN-1305492-A Pyrazinone protease inhibitors DIMENSIONAL PHARM INC (US) 2001-07-25 CN disclosed
CN-1211248-A Novel substituted N-methyl-N-(4-(4-(1H-benzimidazol-2-yl) [1,4] diazepan-1-yl)-1-(aryl) butyl) benzamides useful for treatment of allergic diseases HOECHST MARION ROUSSEL INC (US) 1999-03-17 CN disclosed
EP-0668260-B1 Process for phosgenation in the presence of acetonitrile ZENECA LTD (GB) 1998-08-12 EP disclosed
US-5792888-A Process for phosgenation in the presence of acetonitrile ZENECA LIMITED (GB) 1998-08-11 US disclosed
WO-1996024558-A1 METHOD AND APPARATUS FOR THERMAL DECOMPOSITION AND SEPARATION OF COMPONENTS WITHIN AN AQUEOUS STREAM HPR CORPORATION (US) 1996-08-15 WO disclosed
EP-0668260-A1 Process for phosgenation in the presence of acetonitrile ZENECA LIMITED (GB) 1995-08-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120164188-A1 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES REN, DHPS, AVPR2 TSHR 3098/4885ACHE 4730/4885ALDH1A1 271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.