Nitrobenzene

Nitrobenzene

SCHEMBL2255264

O=[N+]([O-])c1ccccc1.c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 1.00
LMNA P02545 2/20 1.00
TSHR P16473 3/20 0.65
L3MBTL1 Q9Y468 2/20 0.62
MEN1 O00255 1/20 0.62
CRHBP P24387 1/20 0.62
KMT2A Q03164 1/20 0.62
ATM Q13315 1/20 0.62
CRHR2 Q13324 1/20 0.62
TLR9 Q9NR96 1/20 0.62
HPGD P15428 1/20 0.62
ALOX12 P18054 1/20 0.62
CES2 O00748 1/20 0.60
CES1 P23141 1/20 0.60
NFE2L2 Q16236 1/20 0.56
ACHE P22303 2/20 0.55
HSD17B10 Q99714 1/20 0.55
TDP1 Q9NUW8 2/20 0.54
POLB P06746 1/20 0.54
MAPK1 P28482 1/20 0.54

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
Nitrobenzene SCHEMBL1330714 1.00
Nitrobenzene SCHEMBL2358164 1.00 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL15525745 1.00 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL1330825 1.00
Nitrobenzene SCHEMBL20411 1.00
Nitrobenzene SCHEMBL9669095 1.00
Nitrobenzene SCHEMBL25293390 0.97 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL4905356 0.97
Nitrobenzene SCHEMBL9723221 0.97 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL3888503 0.97 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115356435-A Evaluation method for influence of hydrogenation catalyst of raw material benzene p-nitrobenzene and production method of aniline 万华化学(宁波)有限公司 2022-11-18 CN claimed
CN-111909389-B Covalent organic framework material and preparation method and application thereof 山东师范大学 2022-04-15 CN claimed
CN-111909389-A Covalent organic framework material and preparation method and application thereof 山东师范大学 2020-11-10 CN claimed
CN-107597097-A A kind of preparation method and applications of Supported molybdenum oxide catalyst 北京林业大学 2018-01-19 CN claimed
CN-221789208-U Reaction liquid transferring device 兰州汇顺源精细化工有限公司 2024-10-01 CN disclosed
CN-112279446-B TDI (toluene diisocyanate) nitrifying wastewater treatment and resource recovery system and method 安泰丰源环保科技(内蒙古)集团股份有限公司 2024-04-05 CN disclosed
CN-115356435-A Evaluation method for influence of hydrogenation catalyst of raw material benzene p-nitrobenzene and production method of aniline 万华化学(宁波)有限公司 2022-11-18 CN disclosed
CN-115356435-A Evaluation method for influence of hydrogenation catalyst of raw material benzene p-nitrobenzene and production method of aniline 万华化学(宁波)有限公司 2022-11-18 CN disclosed
CN-111909389-B Covalent organic framework material and preparation method and application thereof 山东师范大学 2022-04-15 CN disclosed
CN-109563028-B Method for producing isocyanates and at least one other chemical product in a production complex 科思创德国股份有限公司 2021-11-19 CN disclosed
CN-213865794-U TDI (toluene diisocynate) nitrification wastewater treatment and resource recovery system 河北丰源环保科技股份有限公司 2021-08-03 CN disclosed
CN-109453779-B TiO 22Preparation method and application of modified sepiolite supported nickel-based catalyst 湘潭大学 2021-07-20 CN disclosed
US-20070185294-A1 Polyvinyl pyrrole host material, luminescent layer comprising the same, and organic electroluminescent device comprising the luminescent layer SAMSUNG DISPLAY CO., LTD. (KR) 2007-08-09 US disclosed
CN-1193364-C Record medium, record device and record method TOSHIBA KK (JP) 2005-03-16 CN disclosed
US-6433221-B1 CATALYST FROM OXIDATION OF CYCLOHEXANE TO ADIPIC ACID; SOLVENT EXTRACTION RPC INC. 2002-08-13 US disclosed
US-6433220-B1 CATALYST FROM OXIDATION OF CYCLOHEXANE TO ADIPIC ACID; SOLVENT EXTRACTION RPC INC. 2002-08-13 US disclosed
US-4772757-A Process for the production of nitrobenzene BAYER AKTIENGESELLSCHAFT (DE) 1988-09-20 US disclosed
US-4257986-A OXIDATION OR REDUCTION OF NITROUS ACID, RESIDUAL ORGANICS AIR PRODUCTS AND CHEMICALS, INC. (US) 1981-03-24 US disclosed
US-4130633-A Removal of selenium from urethane solutions ATLANTIC RICHFIELD COMPANY (US) 1978-12-19 US disclosed
US-4054419-A HYDROPHOBIC CATALYST, REDOX REACTION THE MEAD CORPORATION (US) 1977-10-18 US disclosed