SCHEMBL359519

SCHEMBL359519

O=[N+]([O-])c1cc([N+](=O)[O-])c(Cl)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
MAPK1 P28482 1/20 0.60
ALDH1A1 P00352 3/20 0.57
CYP3A4 P08684 1/20 0.57
GPR35 Q9HC97 2/20 0.52
VCAM1 P19320 6/20 0.52
TDP1 Q9NUW8 1/20 0.50
MERTK Q12866 2/20 0.46
PGK1 P00558 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL1626066 0.92 TSHR (0.58) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL30953145 0.92 TSHR (0.58) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL9180125 0.92 TSHR (0.62) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL3980207 0.87 TSHR (0.54) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL838256 0.85 ALDH1A1 (0.71) TSHRMAPK1ALDH1A1CYP3A4VCAM1
SCHEMBL3760236 0.84 TSHR (0.50) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL8767757 0.84 ALDH1A1 (0.63) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL2565885 0.84 ALDH1A1 (0.69) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL8967138 0.84 TDP1 (0.50) TSHRMAPK1ALDH1A1CYP3A4GPR35
SCHEMBL11548194 0.84 ALDH1A1 (0.63) TSHRMAPK1ALDH1A1CYP3A4VCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122032465-A Method for continuously producing 1, 3-dichloro-4, 6-dinitrobenzene 浙江工业大学 2026-05-15 CN claimed
CN-119371315-A Purification method for removing 1, 5-dichloro-2, 4-dinitrobenzene and application thereof 苏利(宁夏)新材料科技有限公司 2025-01-28 CN claimed
CN-118324708-A Synthesis method of flumioxazin intermediate 6-amino-7-fluoro-2H-benzo [ b ] [1,4] oxazin-3 (4H) -ketone 山东滨农科技有限公司 2024-07-12 CN claimed
CN-118239845-A Method for removing dinitro by-product and purifying 2, 4-dichloronitrobenzene crude product 云南云天化股份有限公司 2024-06-25 CN claimed
CN-118063343-A Hydrazino phenoxyacetic acid ethyl ester alpha-glucosidase inhibitor and preparation method and application thereof 上海应用技术大学 2024-05-24 CN claimed
CN-116396172-A Method for removing 1, 5-dichloro-2, 4-dinitrobenzene and application thereof 苏利(宁夏)新材料科技有限公司 2023-07-07 CN claimed
CN-114940780-B Tetra-amide nucleating agent and polypropylene composition 朴蓝聚烯烃科技发展(上海)有限公司 2023-06-30 CN claimed
CN-113912561-B Synthetic method of 6-amino-7-fluoro-2H-1, 4-benzoxazine-3 (4H) -ketone 山东京博农化科技股份有限公司 2023-04-07 CN claimed
CN-114940652-A Tetraaminobenzene derivative and preparation method thereof 朴蓝聚烯烃科技发展(上海)有限公司 2022-08-26 CN claimed
CN-110128647-B Aromatic amide polymer and application thereof 重庆工商大学 2022-02-11 CN claimed
CN-109748798-A A method of synthesis fluoro- 2,4 2,4-dinitrophenoxy of 2-(5-) acetic acid esters 内蒙古世杰化工有限公司 2019-05-14 CN claimed
EP-0710644-B1 Process for the preparation of 4,6-diaminoresorcinol BAYER AG (DE) 1997-09-24 EP claimed
US-5574188-A NITRATING DICHLOROBENZENE, DIBENZYLOXY INTERMEDIATE, MULTISTEP BAYER AKTIENGESELLSCHAFT (DE) 1996-11-12 US claimed
EP-0710644-A1 Process for the preparation of 4,6-diaminoresorcinol BAYER AG (DE) 1996-05-08 EP claimed
EP-0237899-B1 PRODUCTION OF FLUOROANILINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-11 EP claimed
US-4803270-A Process of producing fluoroaniline derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-02-07 US claimed
EP-0237899-A1 Production of fluoroaniline derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-23 EP claimed
EP-0017513-B2 ELECTROPHOTOGRAPHIC MEMBER AND PROCESS FOR FORMING A LATENT IMAGE RANK XEROX LIMITED (GB) 1986-12-30 EP claimed
EP-0017513-B1 ELECTROPHOTOGRAPHIC MEMBER AND PROCESS FOR FORMING A LATENT IMAGE RANK XEROX LIMITED (GB) 1983-01-19 EP claimed
US-4315980-A ELECTRON ACCEPTOR ACTIVATORS FUJI XEROX CO., LTD. (JP) 1982-02-16 US claimed