SCHEMBL478142

SCHEMBL478142

CC(=O)c1ccc(Br)c([N+](=O)[O-])c1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
GAA P10253 1/20 0.56
ALDH1A1 P00352 3/20 0.53
CYP2D6 P10635 1/20 0.53
MAPK1 P28482 2/20 0.52
PDE7A Q13946 1/20 0.51
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TSHR P16473 1/20 0.49
CASP6 P55212 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
VCAM1 P19320 1/20 0.46
PKM P14618 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL29559211 1.00 MAPT (0.56) MAPTGAAALDH1A1CYP2D6MAPK1
SCHEMBL16957059 0.87 ALDH1A1 (0.54) MAPTGAAALDH1A1CYP2D6TSHR
SCHEMBL4313890 0.86 MAPK1 (0.52) MAPTGAAALDH1A1MAPK1PDE7A
SCHEMBL2156916 0.85 CES1 (0.54) MAPTGAAALDH1A1CYP2D6TSHR
SCHEMBL10948000 0.85 VCAM1 (0.62) MAPTGAAALDH1A1CYP2D6MAPK1
SCHEMBL99875 0.84 CASP6 (0.70) TSHRCASP6LMNA
SCHEMBL8625493 0.84 VCAM1 (0.61) MAPTGAAALDH1A1CYP2D6MAPK1
SCHEMBL11690925 0.83 CASP6 (0.69) MAPTALDH1A1MAPK1PDE7APOLB
SCHEMBL3892799 0.82 ALDH1A1 (0.52) MAPTGAAALDH1A1CYP2D6TSHR
SCHEMBL28604140 0.82 PARP1 (0.65) MAPTGAAALDH1A1CYP2D6POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250033082-A1 METHOD AND COMPOSITION FOR REDUCING SOLVENT RELEASE FROM, AND REDUCING ODOR OF, AGROCHEMICAL FORMULATIONS ADAMA MAKHTESHIM LTD. (IL) 2025-01-30 US claimed
CN-118201991-A Methods and compositions for reducing solvent release from agrochemical formulations and reducing agrochemical formulation odor 安道麦马克西姆有限公司 2024-06-14 CN claimed
CN-116554602-A Polypropylene/POE composite thin-wall direct-current cable material and preparation method thereof 西安交通大学 2023-08-08 CN claimed
WO-2023073536-A1 METHOD AND COMPOSITION FOR REDUCING SOLVENT RELEASE FROM, AND REDUCING ODOR OF, AGROCHEMICAL FORMULATIONS ADAMA MAKHTESHIM LTD. (IL) 2023-05-04 WO claimed
CN-113663463-B Odor inhibitor 日东生物科技(浙江)有限公司 2022-08-02 CN claimed
CN-113663463-A Odor inhibitor 日东生物科技(浙江)有限公司 2021-11-19 CN claimed
JP-54144347-A None JP disclosed
US-20250033082-A1 METHOD AND COMPOSITION FOR REDUCING SOLVENT RELEASE FROM, AND REDUCING ODOR OF, AGROCHEMICAL FORMULATIONS ADAMA MAKHTESHIM LTD. (IL) 2025-01-30 US disclosed
CN-116102397-B Flurbiprofen Process for the preparation of a compound containing a compound selected from the group consisting of 沈阳药科大学 2024-08-30 CN disclosed
CN-118201991-A Methods and compositions for reducing solvent release from agrochemical formulations and reducing agrochemical formulation odor 安道麦马克西姆有限公司 2024-06-14 CN disclosed
CN-116554602-A Polypropylene/POE composite thin-wall direct-current cable material and preparation method thereof 西安交通大学 2023-08-08 CN disclosed
CN-116444436-A Synthesis method of aminophenylpyrazole compound 曲靖师范学院 2023-07-18 CN disclosed
CN-114644559-B Preparation method of flurbiprofen or flurbiprofen ester 浙江新和成股份有限公司 2023-05-26 CN disclosed
US-5071988-A Antiu lcer agents, antiallergens cytoprotective agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-12-10 US disclosed
WO-1991006538-A1 SUBSTITUTED BENZOYLBENZENE-, BIPHENYL- AND 2-OXAZOLE- ALKANOIC ACID DERIVATIVES AS INHIBITORS OF PLA2 AND LIPOXYGENASE AMERICAN HOME PRODUCTS CORPORATION (US) 1991-05-16 WO disclosed
JP-S54144347-A 3-(2-FLUORO-4-BIPHENYLYL)-2-BUTANONE NIKKEN KAGAKU KK 1979-11-10 JP disclosed
US-4153807-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS THE BOOTS COMPANY LIMITED (GB) 1979-05-08 US disclosed
US-4053639-A 2-(2,2' OR 2,2'-FLUORO OR DIFLUORO-4-BIPHENYLYL)PROPAN-1-OL; ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC THE BOOTS COMPANY LIMITED (EN) 1977-10-11 US disclosed
US-4048332-A Phenylalkanoic acids THE BOOTS COMPANY LIMITED (EN) 1977-09-13 US disclosed
US-3933472-A Substituted alkylaryl ketones and methods of use as herbicides BUCKMAN LABORATORIES, INC. (US) 1976-01-20 US disclosed