Toluene

Toluene

SCHEMBL135978

CCCC.Cc1ccccc1.N.N

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.69
LMNA P02545 2/20 0.69
TSHR P16473 2/20 0.69
ALOX12 P18054 1/20 0.69
TP53 P04637 1/20 0.43
HPGD P15428 2/20 0.42
TDP1 Q9NUW8 2/20 0.41
HTT P42858 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CYP2C19 P33261 1/20 0.39
PCSK9 Q8NBP7 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
PSIP1 O75475 1/20 0.36
KDM4E B2RXH2 1/20 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 SCHEMBL9060745 1.00 ACHE (0.69) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL9860896 1.00 ACHE (0.69) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL3418554 1.00 ACHE (0.69) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL991792 0.97 ACHE (0.73) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL6581413 0.94 ACHE (0.69) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL6697996 0.87 ACHE (0.79) ACHELMNATSHRALOX12TP53
Toluene SCHEMBL28760923 0.87 ACHE (0.92) ACHELMNATSHRALOX12HPGD
Toluene SCHEMBL27482738 0.87 ACHE (0.92) ACHELMNATSHRALOX12HPGD
Toluene SCHEMBL628172 0.87
Toluene SCHEMBL15009 0.87

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

Appears in 7021 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121825390-B Long-acting flame-retardant spray polyurea elastomer coating and preparation method thereof 山东世纪联合新材料科技有限公司 2026-05-19 CN claimed
CN-116731289-B Epoxy resin composition and high-heat-resistance high-strength high-toughness epoxy prepreg 上海华谊树脂有限公司 2026-05-15 CN claimed
CN-121610091-B High-performance PUSSPCM phase-change self-temperature-regulating asphalt suitable for summer pavement and preparation method thereof 山东科技大学 2026-05-15 CN claimed
US-20260076241-A1 METHOD FOR MANUFACTURING SINTER BONDING FILM, AND METHOD FOR MANUFACTURING POWER SEMICONDUCTOR PACKAGE FOUNDATION FOR RESEARCH AND BUSINESS, SEOUL NATIONAL UNIVERSITY OF SCIENCE AND TECHNOLOGY (KR) 2026-03-12 US claimed
US-20260047054-A1 COMPOSITE ELECTROMAGNETIC WAVE-ABSORBING MATERIAL AND PREPARATION METHOD THEREFOR HEFEI ZHONGYIN NEW MAT CO LTD (CN) 2026-02-12 US claimed
US-20260035607-A1 Well Barriers For Subterranean Storage Of Carbon Dioxide HALLIBURTON ENERGY SERVICES, INC. (US) 2026-02-05 US claimed
US-12509545-B2 Anhydride catalysts for urethane and urethane-urea systems URETHANE SYSTEMS USA LLC (US) 2025-12-30 US claimed
CN-120192632-A Epoxy resin composition, method for producing the same, and electrical insulation 麦克奥迪(厦门)智能电气有限公司 2025-06-24 CN claimed
CN-120157825-A Preparation method of elastic polyurethane material 淄博卓炼新材料科技有限公司 2025-06-17 CN claimed
WO-2025121982-A1 LOW-NOISE TIRE, TIRE INNER POLYURETHANE FOAM SOUND-ABSORBING LINING COMPOSITION FOR MANUFACTURING SAME, AND TIRE INNER POLYURETHANE FOAM SOUND-ABSORBING LINING METHOD USING SAME 김흥태 2025-06-12 WO claimed
US-4738989-A Aliphatic polyurethane compositions and method of preparation URYLON DEVELOPMENT, INC. (US) 1988-04-19 US claimed
EP-0222822-A4 ALIPHATIC POLYURETHANE SPRAYABLE COATING COMPOSITIONS AND METHOD OF PREPARATION. THERMOCELL DEV LTD (US) 1987-07-16 EP claimed
EP-0222822-A1 ALIPHATIC POLYURETHANE SPRAYABLE COATING COMPOSITIONS AND METHOD OF PREPARATION URYLON DEVELOPMENT, INC. (US) 1987-05-27 EP claimed
CN-85101894-A The preparation method of polyurethane compositions having low hysteresis 1987-01-17 CN claimed
EP-0201819-A1 Bicyclic amide acetal/polyamine/polyisocyanate polymers Ashland Oil, Inc. (US) 1986-11-20 EP claimed
WO-1986006387-A1 ALIPHATIC POLYURETHANE SPRAYABLE COATING COMPOSITIONS AND METHOD OF PREPARATION THERMOCELL DEVELOPMENT, LTD. (US) 1986-11-06 WO claimed
US-4616043-A Aliphatic polyurethane sprayable coating compositions and method of preparation THERMOCELL DEVELOPMENT, LTD. (US) 1986-10-07 US claimed
US-4582890-A IMPACT STRENGTH, FAST POLYMERIZATION RATES ASHLAND OIL, INC. (US) 1986-04-15 US claimed
US-4540750-A REACTION PRODUCT WITH EPOXIDE, EPOXY RESIN CURING AGENT CIBA-GEIGY CORPORATION (US) 1985-09-10 US claimed
US-4507459-A AROMATIC DIAMINE CHAIN EXTENDER, TIRES AIR PRODUCTS AND CHEMICALS, INC. (US) 1985-03-26 US claimed