Toluene

Toluene

SCHEMBL240812

Cc1ccccc1.N=C=O

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.65
TSHR P16473 2/20 0.65
LMNA P02545 2/20 0.65
ALOX12 P18054 1/20 0.65
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
VCP P55072 1/20 0.38
BCHE P06276 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MTOR P42345 1/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35

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 SCHEMBL11099704 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL28853719 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL29997697 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL28488283 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL32871 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL1132376 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL57282 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL7745465 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL29088577 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2
Toluene SCHEMBL28174229 1.00 ACHE (0.65) ACHETSHRLMNAALOX12CES2

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 1057 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12359100-B2 System for producing a sealing compound for insulating glass IGK Isolierglasklebstoffe GmbH (DE) 2025-07-15 US claimed
CN-119735527-A Directional arranged low adsorption auxiliary agent and preparation method and application thereof 韩山师范学院 2025-04-01 CN claimed
CN-119285541-A Pyridine dimethoxy phenylsemicarbazide derivative and preparation method and application thereof 浙江师范大学行知学院 2025-01-10 CN claimed
CN-119264015-A Low-energy consumption non-phosgene method for synthesizing toluene diisocyanate 江苏斯尔邦石化有限公司 2025-01-07 CN claimed
CN-118852829-B High-toughness high-permeability PMMA-SAN alloy material and preparation method thereof 合肥科拜尔新材料股份有限公司 2024-12-17 CN claimed
CN-119120824-A High-cleanliness steel and preparation method thereof 河北纵横集团丰南钢铁有限公司 2024-12-13 CN claimed
CN-115677967-B Wear-resistant and weather-resistant TPU material for casters and preparation method thereof 山东一诺威聚氨酯股份有限公司 2024-11-26 CN claimed
US-20240376043-A1 CHEMICAL PRODUCTION ASSEMBLY FOR ISOCYANATES BASF SE (DE) 2024-11-14 US claimed
CN-118852829-A High-toughness high-permeability PMMA-SAN alloy material and preparation method thereof 合肥科拜尔新材料股份有限公司 2024-10-29 CN claimed
CN-118598875-A Pyrimidine diketone amide compound and preparation method and application thereof 广州医科大学 2024-09-06 CN claimed
EP-0842047-A4 WATERBORNE BASECOAT COMPOSITIONS FOR USE IN BASECOAT/CLEARCOAT APPLICATIONS SHERWIN WILLIAMS CO (US) 1998-07-01 EP claimed
EP-0842047-A1 WATERBORNE BASECOAT COMPOSITIONS FOR USE IN BASECOAT/CLEARCOAT APPLICATIONS THE SHERWIN-WILLIAMS COMPANY (US) 1998-05-20 EP claimed
WO-1996040511-A1 WATERBORNE BASECOAT COMPOSITIONS FOR USE IN BASECOAT/CLEARCOAT APPLICATIONS THE SHERWIN-WILLIAMS COMPANY (US) 1996-12-19 WO claimed
CN-1076712-A Single component (resisting) wet solidification polyurethane waterproof coating resin and preparation method thereof XIAO YANGHUA (CN) 1993-09-29 CN claimed
CN-1072708-A A kind of polyurethane conductive lacquer KAILIN PAINT PRODUCING FACTORY (CN) 1993-06-02 CN claimed
EP-0094196-B1 TWO-COMPONENT URETHANE COATING SYSTEM The Lubrizol Corporation (US) 1986-08-27 EP claimed
EP-0063930-B1 POLYURETHANE FOAM BP Chemicals Limited (GB) 1985-10-23 EP claimed
EP-0092454-A1 Halogenated aromatic isocyanates or their mixtures having a diphenyl-methane structure ELF ATOCHEM S.A. (FR) 1983-10-26 EP claimed
WO-1982003865-A1 POLYURETHANE FOAM GUSTHIOT ANDRE 1982-11-11 WO claimed
EP-0063930-A1 Polyurethane foam BP Chemicals Limited (GB) 1982-11-03 EP claimed