Trinitrophenol

Trinitrophenol

SCHEMBL28048084

Cc1ccccc1.O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TRPA1TRPV4

The experimentally established mechanism targets of Trinitrophenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 8/20 0.64
ALDH1A1 P00352 6/20 0.64
CRHBP P24387 1/20 0.59
CRHR2 Q13324 1/20 0.59
MAPT P10636 6/20 0.58
HPGD P15428 4/20 0.58
KDM4E B2RXH2 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
MEN1 O00255 2/20 0.58
ALOX15 P16050 2/20 0.58
ALOX12 P18054 2/20 0.58
KMT2A Q03164 2/20 0.58
HSD17B10 Q99714 2/20 0.58
MAPK1 P28482 2/20 0.58
TTR P02766 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
RECQL P46063 1/20 0.58
PMP22 Q01453 1/20 0.58
HIF1A Q16665 1/20 0.58

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
Trinitrophenol SCHEMBL9443134 0.95 GPR35 (0.63) GPR35ALDH1A1CRHBPCRHR2MAPT
Dinitro Cresol SCHEMBL1509581 0.92 GPR35 (0.78) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL31588165 0.88 GPR35 (0.71) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL9443183 0.88 GPR35 (0.71) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL31588669 0.87 GPR35 (0.73) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL27955220 0.86 CRHBP (0.79) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL27538937 0.86 CRHBP (0.62) GPR35ALDH1A1CRHBPCRHR2MAPT
Toluene SCHEMBL28998637 0.84 GPR35 (0.73) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL28287535 0.84 GPR35 (0.63) GPR35ALDH1A1CRHBPCRHR2MAPT
Trinitrophenol SCHEMBL29086892 0.83 GPR35 (0.74) GPR35ALDH1A1CRHBPCRHR2MAPT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120025859-A Formula of ferrous picrate fuel additive 中勘天府科技(四川)有限公司 2025-05-23 CN claimed
CN-109406740-A A kind of evaluation method of freshwater fish quality 湖北省农业科学院农产品加工与核农技术研究所 2019-03-01 CN claimed
CN-120025859-A Formula of ferrous picrate fuel additive 中勘天府科技(四川)有限公司 2025-05-23 CN disclosed
CN-118318970-A Meat-based prepared vegetable flavoring agent and preparation method thereof 山东凯欣绿色食品股份有限公司 2024-07-12 CN disclosed
CN-117958307-A Algae deodorization device and deodorization method based on tea polyphenol 福建农林大学 2024-05-03 CN disclosed
CN-115104695-B Method for removing fishy smell of crucian 黄冈师范学院 2023-08-15 CN disclosed
CN-115104695-A Method for removing fish smell of crucian 黄冈师范学院 2022-09-27 CN disclosed
CN-108419981-B Yellow croaker fishy smell removing agent and preparation and use methods thereof 浙江万里学院 2021-07-16 CN disclosed
CN-112029818-A Method for screening trimethylamine lyase inhibitor by using microorganisms 中国药科大学 2020-12-04 CN disclosed
CN-109406740-A A kind of evaluation method of freshwater fish quality 湖北省农业科学院农产品加工与核农技术研究所 2019-03-01 CN disclosed
CN-108419981-A Yellow croaker fishy smell removing agent and preparation and use methods thereof 浙江万里学院 2018-08-21 CN disclosed
CN-105136968-B A kind of supramolecular organogel compositions and application thereof 中北大学 2016-08-17 CN disclosed
CN-105136968-A Super-molecular organic gel composition and application thereof UNIV NORTH CHINA 2015-12-09 CN disclosed