Toluene

Toluene

SCHEMBL4498352

Cc1ccccc1.ClC(Cl)(Cl)Cl

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.73
ACHE P22303 4/20 0.73
LMNA P02545 3/20 0.73
ALOX12 P18054 1/20 0.73
TDP1 Q9NUW8 3/20 0.44
HPGD P15428 3/20 0.43
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
POLB P06746 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36

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
Toluene SCHEMBL10989418 0.93
Toluene SCHEMBL8845165 0.90 TSHR (0.69) TSHRACHELMNAALOX12TDP1
Toluene SCHEMBL2353255 0.90 ACHE (0.69) TSHRACHELMNAALOX12TDP1
Toluene SCHEMBL11250184 0.89
Toluene SCHEMBL31493144 0.89 ACHE (0.92) TSHRACHELMNAALOX12TDP1
Toluene SCHEMBL11348456 0.89
Toluene SCHEMBL5141031 0.86
Toluene SCHEMBL7062875 0.86 ACHE (0.85) TSHRACHELMNAALOX12TDP1
SCHEMBL12344943 0.86 ACHE (1.00) TSHRACHELMNAALOX12TDP1
Toluene SCHEMBL8824270 0.86 ACHE (1.00) TSHRACHELMNAALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1250329-C Endotoxin adsorbing agent and preparing method thereof UNIV NANKAI (CN) 2006-04-12 CN claimed
CN-1239210-C Endotoxin absorbing agent for blood perfusion and its preparation method UNIV NANKAI (CN) 2006-02-01 CN claimed
CN-1528511-A Endotoxin adsorbing agent and preparing method thereof 南开大学 2004-09-15 CN claimed
CN-1493368-A Endotoxin absorbing agent for blood perfusion and its preparation method 南开大学 2004-05-05 CN claimed
CN-115468923-A Method for detecting ammonia value in amino silicone oil 湖北兴瑞硅材料有限公司 2022-12-13 CN disclosed
CN-106215819-B The preparation method of konjak portuguese gansu polyose gel microsphere 西南科技大学 2019-01-22 CN disclosed
CN-104725536-B A kind of low entanglement degree ultrahigh molecular weight polyethylene powder and its preparation method of sheet material 宁波大学 2017-03-15 CN disclosed
CN-106215819-A The preparation method of konjak portuguese gansu polyose gel microsphere 西南科技大学 2016-12-14 CN disclosed
CN-101322933-B Endotoxin absorbent and preparation thereof ZHUHAI LIVZON PHARMACY MATERIAL CO LTD 2011-08-10 CN disclosed
CN-101322934-B Method for preparing endotoxin adsorbing agent ZHUHAI LIVZON PHARMACY MATERIAL CO LTD 2010-09-29 CN disclosed
US-7582626-B2 5,6-dihydro-1H-pyridin-2-one compounds ANADYS PHARMACEUTICALS, INC. (US) 2009-09-01 US disclosed
US-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2009-04-30 US disclosed
EP-0257419-A1 Process for the preparation of antibacterial 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-02 EP disclosed
EP-0240632-A2 Heat-shrinkable biaxially drawn polyamide film and process for preparaton thereof MITSUBISHI KASEI POLYTEC COMPANY (JP) 1987-10-14 EP disclosed
US-4622315-A AROMATIC NITRO COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1986-11-11 US disclosed
EP-0198326-A2 Poly-p-phenylene-terephthalamide film and process for producing the same Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-10-22 EP disclosed
US-4535901-A ADHESIVES FOR RUBBER-MTTAL ADHESION/ VERING MIDDLE THERMOPLASTIC ONES; HYGIENE TOYO BOSEKI KABUSHIKI KAISHA (JP) 1985-08-20 US disclosed
US-4370468-A Biaxially drawn polyhexamethylene adipamide film ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1983-01-25 US disclosed
US-4352926-A ISOTROPIC, TOUGHNESS, HEAT RESISTANCE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-10-05 US disclosed
US-4252966-A Biaxially drawn polyhexamethylene adipamide film ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-02-24 US 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-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS HAVCR2, PYGL, HCCS TSHR 4518/4885ACHE 1582/4885LMNA 1248/4885

“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.