Dinitrophenylene

Dinitrophenylene

SCHEMBL27369470

CCC(C)c1ccccc1O.O=[N+]([O-])c1cccc([N+](=O)[O-])c1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.62
LMNA P02545 1/20 0.50
ALDH1A1 P00352 2/20 0.47
ALOX15 P16050 1/20 0.47
DDX3X O00571 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
ACHE P22303 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 2/20 0.43
RAB9A P51151 1/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
Dinitrophenylene SCHEMBL27702549 0.86 GABRA1 (0.58) TSHRLMNAALDH1A1ALOX15DDX3X
SCHEMBL27455401 0.83 TSHR (0.68) TSHRALDH1A1ALOX15HDAC4HDAC2
SCHEMBL8041378 0.81 SMN1; SMN2 (0.51) TSHRLMNAALDH1A1MAPTMAPK1
SCHEMBL27548526 0.80 TSHR (0.58) TSHRALDH1A1ALOX15HDAC4HDAC2
Dinitrophenylene SCHEMBL27548525 0.79 ALDH1A1 (0.51) TSHRLMNAALDH1A1ALOX15CES2
Dinitrophenylene SCHEMBL27691692 0.79 TSHR (0.74) TSHRLMNAALDH1A1ALOX15DDX3X
SCHEMBL20721726 0.79 TSHR (1.00) TSHRLMNAALDH1A1ALOX15HDAC4
SCHEMBL282162 0.79 TSHR (1.00) TSHRLMNAALDH1A1ALOX15HDAC4
SCHEMBL15485172 0.79 TSHR (1.00) TSHRLMNAALDH1A1ALOX15HDAC4
Dinitrophenylene SCHEMBL27702402 0.78 TSHR (0.57) TSHRLMNAALDH1A1ALOX15DDX3X

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-104447298-B The preparation method of Benzoyl chloride SHANDONG KAISHENG NEW MATERIALS CO., LTD. (CN) 2016-03-30 CN claimed
CN-105440252-A UV-curable waterborne polyurethane modified epoxy itaconic acid resin and preparation method thereof UNIV GUANGZHOU 2016-03-30 CN claimed
CN-102942672-B A kind of polyester-polyether type polyurethane acrylate and synthetic method thereof YANTAI DARBOND TECHNOLOGY CO., LTD. (CN) 2016-03-02 CN claimed
CN-105348130-A Preparation method of N,N-dimethyl propyl acrylamide TIANJIN JIURI NEW MATERIALS CO LTD 2016-02-24 CN claimed
CN-104447182-B Can Magneto separate solid phase stopper and preparation method thereof and application TIANJIN UNIVERSITY OF SCIENCE & TECHNOLOGY (CN) 2016-02-10 CN claimed
CN-105296027-A Gasoline octane value booster and preparation method thereof XI AN JIAHONG PETROCHEMICAL TECHNOLOGY CO LTD 2016-02-03 CN claimed
CN-104974129-A Extraction agent for separating high-boiling-point component generated in production process of 4,4-dimethyl-1,3-dioxane and application of extraction agent CHINA PETROLEUM & CHEMICAL 2015-10-14 CN claimed
CN-104974130-A Method for separating and preparing 4,4-dimethyl-1,3-dioxane CHINA PETROLEUM & CHEMICAL 2015-10-14 CN claimed
CN-104744206-A Method for extractive distillation recovery of styrene from pyrolysis gasoline C8 fraction CHINA PETROLEUM & CHEMICAL 2015-07-01 CN claimed
CN-103664498-B Method for separating styrene from hydrocarbon mixture by extractive distillation CHINA PETROLEUM & CHEMICAL 2015-04-29 CN claimed
CN-101044106-A Sulfonated phenols and nitrophenols as polymerization inhibitors CHEMTURA CORP (US) 2007-09-26 CN claimed
CN-101031528-A Sulfonated nitrophenols as polymerization inhibitors CHEMTURA CORP (US) 2007-09-05 CN claimed
CN-1962572-A Polymerization inhibitor CHINA PETROLEUM & CHEMICAL (CN) 2007-05-16 CN claimed
CN-1962582-A Process for prohibiting polymerization of styrene CHINA PETROLEUM & CHEMICAL (CN) 2007-05-16 CN claimed
CN-1939951-A Production of aryl-alkyl-substituted hydroxy-benzoic acid resin multivalent metal salt RUIFENG CHEMICAL CO LTD XINXIA (CN) 2007-04-04 CN claimed
CN-1230492-C Compositions and methods for inhibiting polymerization and polymer growth UNIROYAL CHEM CO INC (US) 2005-12-07 CN claimed
CN-1427809-A Nitroaromatic solubilizers for nitroxyl compounds in aromatic solvents UNIROYAL CHEM CO INC (US) 2003-07-02 CN claimed
CN-1411499-A Composition and method for inhibiting polymerization and polymer growth UNIROYAL CHEM CO INC (US) 2003-04-16 CN claimed
CN-1041513-C Inhibiting polymerization of vinyl aromatic monomers CIBA GEIGY AG (CH) 1999-01-06 CN claimed
CN-1084155-A The resistance of vi-ny l aromatic monomers is poly- CIBA GEIGY AG (US) 1994-03-23 CN claimed