SCHEMBL856759

SCHEMBL856759

O=[N+]([O-])c1ccccc1NBr

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
ALDH1A1 P00352 3/20 0.60
TDP1 Q9NUW8 2/20 0.60
CASP7 P55210 1/20 0.60
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
MAPT P10636 7/20 0.53
GAA P10253 3/20 0.53
PKM P14618 1/20 0.53
KAT2B Q92831 2/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
IDO1 P14902 1/20 0.49
EPAS1 Q99814 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KCNMA1 Q12791 1/20 0.49
HSD17B10 Q99714 1/20 0.48
POLB P06746 1/20 0.47

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
Nitrogen SCHEMBL28695213 0.96 MAPK1 (0.56) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL397773 0.82 MAPK1 (0.77) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL4793372 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL297021 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL728448 0.78 MEN1 (0.61) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL12205174 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL973213 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL373368 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL950729 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7
SCHEMBL355102 0.78 MAPK1 (0.60) MAPK1L3MBTL1ALDH1A1TDP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119100999-A Synthesis method of plant extract cardanol modified benzotriazole ultraviolet absorber 烟台新特路新材料科技有限公司 2024-12-10 CN claimed
CN-110305018-A A kind of preparation method of the bromo- 2- fluoronitrobenzene of 3- 浙江普洛家园药业有限公司 2019-10-08 CN claimed
CN-109467535-A A kind of preparation method of Fenbendazole 江苏宝众宝达药业有限公司 2019-03-15 CN claimed
CN-105669520-B O-phenylenediamine class selectivity histon deacetylase (HDAC) inhibitor containing tryptophan basic framework and its preparation method and application 山东大学 2018-10-30 CN claimed
CN-105669520-A Tryptophan basic skeleton-containing o-phenylenediamine selective histone deacetylase inhibitor and its preparation method and use 山东大学 2016-06-15 CN claimed
CN-103728294-B Bisbenzimidazole connection carbazole compound is for specific binding nucleic acid G-tetra-chain body structures and in the application of antineoplastic INSTITUTE OF CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2016-05-11 CN claimed
CN-103728294-A Applications of bisbenzimidazole bicarbazole compound in specific binding nucleic acid G-quadruplex structure and anti-tumor drug CHINESE ACAD INST CHEMISTRY 2014-04-16 CN claimed
CN-119100999-A Synthesis method of plant extract cardanol modified benzotriazole ultraviolet absorber 烟台新特路新材料科技有限公司 2024-12-10 CN disclosed
CN-111164074-B Heat shock protein 90 inhibitors 台北医学大学 2024-02-02 CN disclosed
CN-115433092-A Synthesis process of 4-bromo o-phenylenediamine 苏州信礼发医药技术有限公司 2022-12-06 CN disclosed
CN-110305018-B Preparation method of 3-bromo-2-fluoronitrobenzene 浙江普洛家园药业有限公司 2022-07-15 CN disclosed
WO-2021138392-A1 AMINOPYRIMIDINE COMPOUNDS TYRA BIOSCIENCES, INC. (US) 2021-07-08 WO disclosed
CN-111164074-A Heat shock protein 90 inhibitor 台北医学大学 2020-05-15 CN disclosed
CN-101472585-B Antibacterial compositions BIOTA EUROPE LTD 2013-12-04 CN disclosed
CN-101445469-B Inhibitors of histone deacetylase METHYLGENE INC 2013-02-13 CN disclosed
EP-2432779-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES Exelixis, Inc. (US) 2012-03-28 EP disclosed
CN-102170882-A Compositions and methods of treating amyloid disease TREVENTIS CORP 2011-08-31 CN disclosed
WO-2010135524-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES EXELIXIS, INC. (US) 2010-11-25 WO disclosed
EP-1497287-B1 Quinoline derivatives in combination with 5-FU or CPT-11 for use in the treatment of cancer NOVARTIS VACCINES & DIAGNOSTIC (US) 2010-11-24 EP disclosed
CN-101389630-A Protein kinase inhibitors ABBOTT LAB (US) 2009-03-18 CN disclosed