Trinitrotoluene

Trinitrotoluene

SCHEMBL20676

Cc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
GPR35 Q9HC97 5/20 0.61
TSHR P16473 3/20 0.58
TDP1 Q9NUW8 5/20 0.56
MAPK1 P28482 3/20 0.54
MAPT P10636 3/20 0.54
CYP1A2 P05177 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGD P15428 2/20 0.54
HIF1A Q16665 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
TTR P02766 1/20 0.54
CYP2C9 P11712 1/20 0.54
ALOX15 P16050 1/20 0.54
ALOX12 P18054 1/20 0.54
RECQL P46063 1/20 0.54
PMP22 Q01453 1/20 0.54
HSD17B10 Q99714 1/20 0.54
CYP3A4 P08684 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
Trinitrotoluene SCHEMBL891182 1.00 ALDH1A1 (0.61) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL9101080 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL14966251 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL29643505 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL1272395 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL14966503 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL9101074 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL28861138 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL2566651 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1
Trinitrotoluene SCHEMBL28218293 0.98 ALDH1A1 (0.59) ALDH1A1GPR35TSHRTDP1MAPK1

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 49548 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146010-A1 ENERGETIC MATERIAL MIXING DEVICE AND PROCESS GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2026-05-28 US claimed
CN-122090493-A AU structure-based dependency enhancement and multi-level prototype polymerization micro-expression recognition method 2026-05-26 CN claimed
CN-122079711-A Composite energetic material and preparation method and application thereof 2026-05-26 CN claimed
CN-122088075-A POZD anti-explosion coating thickness calculation method 2026-05-26 CN claimed
CN-122079555-A Building material preparation method based on multi-source solid waste and high-strength heat-insulating board 2026-05-26 CN claimed
CN-121521598-B Magnetorheological fluid and metal spring plate composite regulation drop hammer impact test device and method TIANJIN CHENGJIAN UNIVERSITY (CN) 2026-05-26 CN claimed
US-20260140005-A1 PROBABILISTIC REPRESENTATION METHOD FOR UNDERWATER EXPLOSION SHOCK WAVE LOAD BASED ON BAYESIAN REASONING JIANGHAN UNIVERSITY (CN) 2026-05-21 US 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-117756646-B Retired TNT catalytic hydrogenation process 齐鲁工业大学(山东省科学院) 2026-05-19 CN claimed
CN-119841401-B Electrode material for H-type electrolytic tank and method for simultaneously degrading typical explosive-deficient/explosive-rich wastewater 南京理工大学 2026-05-19 CN claimed
US-4000021-A Process for suspending particulate additives in molten TNT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-12-28 US claimed
US-3985077-A Ogival lens warhead THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1976-10-12 US claimed
US-3981934-A Method for drying trinitrotoluene DYNO INDUSTRIER A.S. (NO) 1976-09-21 US claimed
US-3969413-A Hydroformylation process using catalyst comprising cobalt and polynitroaryl compounds UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-07-13 US claimed
US-3959041-A ZIRCONIUM, TITANIUM OR MISCH METAL THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-05-25 US claimed
US-3957550-A EXPLOSIVES, LIQUID FUELS, OXIDIZERS THIOKOL CORPORATION (US) 1976-05-18 US claimed
US-3956039-A ORTHO-BORIC ACID, TRINITROTOLUENE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES ENERGY RESEARCH AND DEVELOPMENT ADMINISTRATION (US) 1976-05-11 US claimed
US-3956409-A REACTING TRINITROTOLUENE WITH AMMONIUM SULFITE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1976-05-11 US claimed
US-3954532-A NITRATED 2,5,8-TRIPHENYL-TRIS-TRIAZOLOBENZENE DERIVATIVE VEGYI- ES ROBBANOANYAGIPARI FELUGYELET (HU) 1976-05-04 US claimed
US-3943820-A Method for charging drill holes with explosive NITRO NOBEL AB (SW) 1976-03-16 US claimed