Toluene

Toluene

SCHEMBL906170

CCCO.Cc1ccccc1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
ACHE P22303 3/20 0.61
TSHR P16473 2/20 0.61
ALOX12 P18054 1/20 0.61
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PCSK9 Q8NBP7 1/20 0.41
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
HTT P42858 1/20 0.37
CYP2C19 P33261 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
Toluene SCHEMBL11300497 1.00 LMNA (0.61) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL8099662 0.97 LMNA (0.58) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL28909185 0.97 LMNA (0.58) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL11299856 0.95 LMNA (0.55) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL5199381 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL22729215 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL5198578 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL28769535 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL409208 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1
Toluene SCHEMBL27342895 0.88 ACHE (0.69) LMNAACHETSHRALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113041848-B Method for preparing block copolymer hollow fiber membrane by combining selective swelling and melt-spinning stretching method 南京工业大学 2022-09-16 CN claimed
EP-3883524-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS Emerald Kalama Chemical, LLC (US) 2021-09-29 EP claimed
US-20210292680-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS LANXESS CORPORATION 2021-09-23 US claimed
CN-113041848-A Method for preparing block copolymer hollow fiber membrane by combining selective swelling and melt-spinning stretching method 南京工业大学 2021-06-29 CN claimed
CN-111318174-A Method for preparing block copolymer hollow fiber membrane based on selective swelling method 南京工业大学 2020-06-23 CN claimed
CN-106336337-B A method of being thermally integrated variable-pressure rectification separation of methylbenzene and normal propyl alcohol azeotropic mixture 青岛科技大学 2019-01-08 CN claimed
CN-107602709-A A kind of carboxymethyl nano cellulose material cleans preparation method 北京理工大学 2018-01-19 CN claimed
CN-106336337-A Method for separating toluene and n-propanol azeotrope through heat-integrated pressure-swing distillation 青岛科技大学 2017-01-18 CN claimed
CN-106242412-A Surface tension adjusts shrinkage type polycarboxylate water-reducer purposes in preparing regenerated aggregate concrete 广东红墙新材料股份有限公司 2016-12-21 CN claimed
CN-103588906-A Preparation method for 1-(4-methylphenyl)-1-propanol substituted 6-amino-beta-cyclodextrin derivative SHANGHAI RUICHUANG MEDICAL TECHNOLOGY CO LTD 2014-02-19 CN claimed
CN-102359994-B Detection method for polychlorinated naphthalene content in electronic and electrical product rubber part INSPECTION & QUARANTINE TECH CT OF GUANGDONG ENTRY EXIT INSPECTION & QUARANTINE BUREAU 2014-01-08 CN claimed
CN-102816257-A Preparation method of methoxylphenyl propanol substituted 6-amino-beta-cyclodextrin derivative SHANGHAI RUICHUANG MEDICAL TECHNOLOGY CO LTD 2012-12-12 CN claimed
CN-102359994-A Detection method for polychlorinated naphthalene content in electronic and electrical product rubber part INSPECTION & QUARANTINE TECH CT OF GUANGDONG ENTRY EXIT INSPECTION & QUARANTINE BUREAU 2012-02-22 CN claimed
CN-1267295-A Processes for preparation of pyridine derivs. EISAI CO LTD (JP) 2000-09-20 CN claimed
US-5830835-A FABRIC SOFTENER, PERFUME ESTER MIXTURES PROCTER & GAMBLE COMPANY (US) 1998-11-03 US claimed
US-5668102-A SOLID OR LIQUID COMPOSITION CONTAINING CATIONIC QUATERNARY AMMONIUM FABRIC SOFTENING COMPOUND, NONIONIC OR ANIONIC ESTER OF NON-ALLYLIC ALCOHOL PERFUME THE PROCTER & GAMBLE COMPANY (US) 1997-09-16 US claimed
CN-119584989-A Hyaluronic acid derivative pharmaceutical composition and method for producing pharmaceutical composition 旭化成株式会社 2025-03-07 CN disclosed
CN-119486761-A Hyaluronic acid derivative pharmaceutical composition and pharmaceutical composition 旭化成株式会社 2025-02-18 CN disclosed
US-4152345-A FOR USE IN PLATING BATHS, HORTICULTURE, STAIN REMOVAL W. R. GRACE & CO. (US) 1979-05-01 US disclosed
US-4069249-A CHELATING AGENTS W. R. GRACE & CO. (US) 1978-01-17 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-20210292680-A1 MULTIFUNCTIONAL AROMATIC ALCOHOLS FOR PERSONAL CARE, HOME CARE AND INDUSTRIAL AND INSTITUTIONAL COMPOSITIONS PAH, TYR, EP300 LMNA 3852/4885ACHE 2213/4885TSHR 3285/4885

“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.