Toluene

Toluene

SCHEMBL22497424

Cc1ccccc1.O=C(c1ccccc1)c1ccc(S)cc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
LMNA P02545 3/20 0.58
SRD5A2 P31213 3/20 0.55
CES2 O00748 1/20 0.55
CES1 P23141 1/20 0.55
AKR1C3 P42330 1/20 0.52
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HPGD P15428 2/20 0.50
CNR2 P34972 2/20 0.49
ELANE P08246 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 1/20 0.47
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47

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
SCHEMBL1127547 0.89 ALDH1A1 (0.70) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL17416119 0.87 ALDH1A1 (0.67) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL28039793 0.87 ALDH1A1 (0.67) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL28040182 0.87 ALDH1A1 (0.67) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL1128110 0.87 ALDH1A1 (0.76) ALDH1A1LMNASRD5A2CES2CES1
Benzophenone SCHEMBL27484013 0.87 ALDH1A1 (0.74) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL259065 0.85 ALDH1A1 (0.80) ALDH1A1LMNASRD5A2CES2CES1
SCHEMBL235 0.85 ALDH1A1 (0.80) ALDH1A1LMNASRD5A2CES2CES1
Benzophenone SCHEMBL5162782 0.85 ALDH1A1 (0.80) ALDH1A1LMNASRD5A2CES2CES1
Toluene SCHEMBL10782841 0.85 ALDH1A1 (0.80) ALDH1A1LMNASRD5A2CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640261-A Silicon-containing vegetable oil-based dual UV (ultraviolet) curing material and preparation method and application thereof 华南农业大学 2023-08-25 CN claimed
CN-114805855-B Bioactive hydrogel with controllable charges and preparation method and application thereof 华中科技大学同济医学院附属同济医院 2023-03-10 CN claimed
CN-115043998-A Method for preparing magnetic polymer by utilizing glycosyl or phenylallyl monomer through photopolymerization reaction, polymer prepared by method and application of polymer 广州医科大学 2022-09-13 CN claimed
CN-114805855-A Bioactive hydrogel with controllable charge and preparation method and application thereof 华中科技大学同济医学院附属同济医院 2022-07-29 CN claimed
CN-111992151-B preparation method of pH stimulation responsive slow-release hybrid microspheres 淮阴工学院 2022-05-27 CN claimed
CN-110437376-B High-precision 3D printing thermochromic material and preparation method and application method thereof 湖南昇微新材料有限公司 2022-05-17 CN claimed
CN-110437385-B Photochromic material for 3D printing and preparation method and application method thereof 湖南昇微新材料有限公司 2022-04-22 CN claimed
CN-114058036-A Preparation method of attapulgite/polyacrylic acid composite microspheres loaded with metal nanoparticles 淮阴工学院 2022-02-18 CN claimed
CN-113956409-A Conductive resin for 3D printing technology and preparation method and application thereof 西南医科大学 2022-01-21 CN claimed
CN-113292910-A Bio-based multifunctional flame-retardant epoxy acrylate and preparation method and application thereof 华南农业大学 2021-08-24 CN claimed
CN-111849327-B preparation method of pH stimulation responsiveness intelligent self-warning self-repairing anticorrosion water-based coating 淮阴工学院 2021-08-17 CN claimed
CN-113234185-A Method for preparing cyclic polymer by [3+2] cyclization reaction by using allyl monomer, polymer prepared by method and application of polymer 广州医科大学 2021-08-10 CN claimed
CN-110200937-B Preparation method of porous hybrid microspheres with slow release performance 淮阴工学院 2021-04-23 CN claimed
CN-110272679-B Ultraviolet light curing paint phenolic hyperbranched super-amphiphobic anticorrosive paint and preparation method thereof 西北农林科技大学 2021-04-09 CN claimed
CN-111992151-A preparation method of pH stimulation responsive slow-release hybrid microspheres 淮阴工学院 2020-11-27 CN claimed
CN-111849327-A preparation method of pH stimulation responsiveness intelligent self-warning self-repairing anticorrosion water-based coating 淮阴工学院 2020-10-30 CN claimed
CN-107522827-B Photocuring 3D printing photosensitive resin and preparation method and application thereof 杨军 2020-08-21 CN claimed
CN-116640261-A Silicon-containing vegetable oil-based dual UV (ultraviolet) curing material and preparation method and application thereof 华南农业大学 2023-08-25 CN disclosed
WO-2020200020-A1 HEXAARYLBIIMIDAZOLE PHOTOINITIATOR AND APPLICATION THEREOF 常州格林感光新材料有限公司 2020-10-08 WO disclosed
CN-109207092-A Toilet floor tile adhesive, preparation method and the application in anti-seepage construction 南京嘉怡装饰设计有限公司 2019-01-15 CN disclosed