Nitrobenzene

Nitrobenzene

SCHEMBL2744753

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

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.94
▸ LMNA P02545 2/20 0.94
▸ TSHR P16473 2/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ HPGD P15428 2/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ CRHBP P24387 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ ATM Q13315 1/20 0.60
▸ CRHR2 Q13324 1/20 0.60
▸ TLR9 Q9NR96 1/20 0.60
▸ ALOX12 P18054 1/20 0.60
▸ CES2 O00748 1/20 0.58
▸ CES1 P23141 1/20 0.58
▸ NFE2L2 Q16236 1/20 0.54
▸ ACHE P22303 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ MAPK1 P28482 1/20 0.52

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 SCHEMBL9669095 0.97 — —
Nitrobenzene SCHEMBL15525745 0.97 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1HPGD
Nitrobenzene SCHEMBL2255264 0.97 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1HPGD
Nitrobenzene SCHEMBL20411 0.97 — —
Nitrobenzene SCHEMBL1330714 0.97 — —
Nitrobenzene SCHEMBL1330825 0.97 — —
Nitrobenzene SCHEMBL2358164 0.97 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1HPGD
Nitrobenzene SCHEMBL25293390 0.94 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1HPGD
Nitrobenzene SCHEMBL3888506 0.94 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1HPGD
Nitrobenzene SCHEMBL10466523 0.94 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4009972-A1 \"TRPSWITCH\" - A STEP FUNCTION CHEMO-OPTOGENETIC LIGAND University of Utah Research Foundation (US) 2022-06-15 — — EP claimed
WO-2021030165-A1 \"TRPSWITCH\" − A STEP FUNCTION CHEMO-OPTOGENETIC LIGAND UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2021-02-18 — — WO claimed
CN-108267527-B Method for measuring nitrogen stable isotope of nitrate in water body 北京农业质量标准与检测技术研究中心 2020-09-11 — — CN claimed
CN-109721600-A A kind of nitrogenous fused ring compound and its preparation method and application 如东凌达生物医药科技有限公司 2019-05-07 — — CN claimed
CN-108929244-A A kind of diazonium method of tide product nitrobenzene amine 江苏之江化工有限公司 2018-12-04 — — CN claimed
US-9981905-B2 Aromatic diamine, an intermediate therefor, a method for producing the aromatic diamine, and a method for producing the intermediate therefor SEIKA CORPORATION (JP) 2018-05-29 — — US claimed
US-20180072655-A1 AROMATIC DIAMINE, AN INTERMEDIATE THEREFOR, A METHOD FOR PRODUCING THE AROMATIC DIAMINE, AND A METHOD FOR PRODUCING THE INTERMEDIATE THEREFOR SEIKA CORPORATION (JP) 2018-03-15 — — US claimed
CN-102791865-A Improved techniques for transfecting protoplasts KEYGENE NV 2012-11-21 — — CN claimed
US-8178274-B2 Toner process XEROX CORPORATION (US) 2012-05-15 — — US claimed
CN-102053448-A Nitroaniline chiral non-linear optical material FUJIAN INST RES STR MATTER CAS 2011-05-11 — — CN claimed
CN-101928613-A The compoistion and method of use that contains ignition dope AFTON CHEMICAL CORP 2010-12-29 — — CN claimed
US-20100015544-A1 TONER PROCESS XEROX CORPORATION (US) 2010-01-21 — — US claimed
CN-101363870-A Bio-sensing chip and method for making same UNIV TSINGHUA (CN) 2009-02-11 — — CN claimed
US-6544705-B2 Having a volume average diameter of 2-10 microns with a size distribution span value of less than 1.0. DPI SOLUTIONS, INC. (KR) 2003-04-08 — — US claimed
US-6531255-B2 Polyester or styrene copolymer with microserrated surface provided with functional sites suitable for interacting with functionalized dyes DPI SOLUTIONS, INC. (KR) 2003-03-11 — — US claimed
US-20020182527-A1 Micro-serrated, dyed color toner particles and method of making same DPI SOLUTIONS, INC. (KR) 2002-12-05 — — US claimed
US-20020172881-A1 Micro-serrated particles for use in color toner and method of making same DPI SOLUTIONS, INC. (KR) 2002-11-21 — — US claimed
CN-86100691-A The Herbicidal mixture of N-((phosphonomethyl) glycyl) sulfonamide type compound — 1986-12-03 — — CN claimed
CN-122016677-A Online concentration detection system and method for quaternary ammonium salt bactericide based on circulating water system 南方电网电力科技股份有限公司 2026-05-12 — — CN disclosed
US-4142915-A OXIDATION OF FERROUS SULFATE, REDUCTION OF AROMATIC NITRO COMPOUND EUTECO S.P.A. (IT) 1979-03-06 — — 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-20180072655-A1 AROMATIC DIAMINE, AN INTERMEDIATE THEREFOR, A METHOD FOR PRODUCING THE AROMATIC DIAMINE, AND A METHOD FOR PRODUCING THE INTERMEDIATE THEREFOR ALDH7A1, ODC1, ASS1 ALDH1A1 173/4885LMNA 2399/4885TSHR 3499/4885

“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.

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