4-Nitrotoluene

4-Nitrotoluene

SCHEMBL73252

Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 1.00
HSD17B10 Q99714 2/20 1.00
ALDH1A1 P00352 5/20 0.56
TSHR P16473 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
RECQL P46063 1/20 0.56
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
BCHE P06276 1/20 0.55
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.54
PKM P14618 1/20 0.53
CES1 P23141 1/20 0.52
CYP3A4 P08684 1/20 0.52
HSP90AA1 P07900 1/20 0.52
CXCR5 P32302 1/20 0.52
APLNR P35414 1/20 0.52
RAB9A P51151 1/20 0.52
CCR6 P51684 1/20 0.52
GFER P55789 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
4-Nitrotoluene SCHEMBL2484690 1.00 ACHE (1.00) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL28533556 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL28159293 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL28284448 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL9402408 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL9734611 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL6751959 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL29272601 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL28481150 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1
4-Nitrotoluene SCHEMBL28124015 0.97 ACHE (0.95) ACHEHSD17B10ALDH1A1TSHRTDP1

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

Appears in 13651 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447329-B Method for preparing nitrobenzaldehyde by direct oxidation of nitrotoluene INSTITUTE OF COAL CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2026-05-26 CN claimed
CN-122070479-A Ultrasonic indicating device and method for monitoring ultrasonic treatment JP实验室股份有限公司 2026-05-19 CN claimed
CN-118142583-B Method for catalyzing nitro compound hydrogenation by porous polymer-based metal catalyst 浙江大学 2026-05-12 CN claimed
EP-4288481-B1 PROCESS FOR MODIFYING AN AROMATIC POLYETHER BACKBONE AND A MODIFIED POLYETHER OBTAINED BY THIS PROCESS UNIV BERLIN TECH (DE) 2026-05-06 EP claimed
EP-4106071-B1 ELECTROLYTE FOR LITHIUM-SULFUR SECONDARY BATTERY AND LITHIUM-SULFUR SECONDARY BATTERY COMPRISING SAME LG ENERGY SOLUTION LTD (KR) 2026-04-29 EP claimed
US-20260110607-A1 TRANSPORT AND DETECTION OF EXPLOSIVE SAMPLES WITH MINIMIZED FALSE POSITIVES ALTI LLC (US) 2026-04-23 US claimed
EP-4244183-B1 PROCESS FOR CONCENTRATING DILUTED SULFURIC ACID BASF SE (DE) 2026-02-11 EP claimed
EP-4682137-A1 EFFICIENT ENERGY USE IN CHEMICAL PROCESSES BASF SE (DE) 2026-01-21 EP claimed
US-12517047-B2 Transport and detection of explosive samples ALTI LLC (US) 2026-01-06 US claimed
US-12512514-B2 Electrolyte solution for lithium-sulfur secondary battery and lithium-sulfur secondary battery comprising same LG ENERGY SOLUTION, LTD. (KR) 2025-12-30 US claimed
US-4022844-A DINITROTOLUENE, NITRIC ACID, SULFURIC ACID SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1977-05-10 US claimed
US-4009060-A Primer composition for use with explosive charges ATLAS POWDER COMPANY (US) 1977-02-22 US claimed
US-4007223-A OXIDATION OF P-NITROTOLUENE, COBALT AND BROMINE CONTAINING CATALYST DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) 1977-02-08 US claimed
US-3997654-A Method for the production of carbonaceous articles, particularly strands BERGWERKSVERBAND GMBH (DT) 1976-12-14 US claimed
US-3981831-A REACTION OF ORGANIC POLYISOCYANATE WITH ALKALI METAL SILICATE OR SILICA SOL BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US claimed
US-3975452-A Reprocessing of final acid from nitroglycerine production FIRMA JOSEF MEISSNER (DT) 1976-08-17 US claimed
US-3973971-A REACTION WITH FORMALDEHYDE, NITRO COMPOUND OR ALUMINUM, ZINC, OR SULFUR KOPPERS COMPANY, INC. (US) 1976-08-10 US claimed
US-3966411-A Analysis for nitrogen compounds by gas chromatography ROSS WILLIAM D 1976-06-29 US claimed
US-3943820-A Method for charging drill holes with explosive NITRO NOBEL AB (SW) 1976-03-16 US claimed
US-3936469-A Process for preparing N-carboxylic anhydrides of amino acids KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JA) 1976-02-03 US claimed