SCHEMBL42140

SCHEMBL42140

Nc1cccc(Br)n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Cyanide SCHEMBL28324060 0.93 NOS2 (0.44)
Acetonitrile SCHEMBL28295797 0.87 NOS3 (0.45)
SCHEMBL3898971 0.82 NOS3 (0.36)
Trifluoroacetic Acid SCHEMBL13837127 0.80 CXCR4 (0.37)
Hydrazine SCHEMBL28032998 0.79 HTR7 (0.38)
SCHEMBL64599 0.78
SCHEMBL3973 0.78
SCHEMBL14733016 0.77 NOS2 (0.42)
Ammonia Solution, Strong SCHEMBL10709860 0.76 NOS2 (0.60)
Hydrochloric Acid SCHEMBL8446392 0.76 NOS2 (0.60)

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 2911 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011978-A High-permeability and high-strength PET (polyethylene terephthalate) stripping adhesive Water-based pressure-sensitive adhesive and preparation method thereof 广东欧陆高新材料有限公司 2026-05-12 CN claimed
US-20260085157-A1 Metal-backboned polymer and preparation method and use thereof FUDAN UNIVERSITY (CN) 2026-03-26 US claimed
CN-119462650-A Non-goetide method for synthesizing nylon 沈阳药科大学 2025-02-18 CN claimed
US-12172977-B2 2,2-dimethyl-n-[6-(1-methyl-piperidin-4-carbonyl)-pyridin-2-yl]-propionamide, method for preparing (6-amino-pyridin-2-yl)-(1-methyl-piperidin-4-yl)-methanone using said compound, and use of said compound in the preparation of lasmiditan Moehs Ibérica, S.L. (ES) 2024-12-24 US claimed
WO-2024093176-A1 HIGH POLYMER CONTAINING METAL ELEMENT AS MAIN CHAIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF 复旦大学 2024-05-10 WO claimed
CN-113045540-B Preparation method of masmipide 上海天慈国际药业有限公司 2024-02-13 CN claimed
CN-117382284-A Corrosion-resistant antibacterial high-performance fiber fabric and preparation method thereof 安徽东锦高科新材料有限公司 2024-01-12 CN claimed
CN-117026657-A Plastic rope with good ageing resistance and production method thereof 界首市宏利塑料股份有限公司 2023-11-10 CN claimed
CN-115894958-B Metal main chain polymer with precise length and synthesis method and application thereof 复旦大学 2023-11-07 CN claimed
CN-114957108-B Oilfield acidizing fracturing cleanup additive 东营施普瑞石油工程技术有限公司 2023-11-03 CN claimed
WO-2014002057-A1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS NOVARTIS AG (CH) 2014-01-03 WO claimed
CN-103265543-A Inhibiting transient receptor potential ion channel TRPA1 HYDRA BIOSCIENCES INC 2013-08-28 CN claimed
WO-2013023102-A1 INHIBITING TRANSIENT RECEPTOR POTENTIAL ION CHANNEL TRPA1 HYDRA BIOSCIENCES, INC. (US) 2013-02-14 WO claimed
EP-1844044-B1 THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2010-07-21 EP claimed
US-7678815-B2 Thiazole-4-carboxyamide derivatives HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US claimed
EP-1844044-A1 THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2007-10-17 EP claimed
US-20060160857-A1 Thiazole-4-carboxyamide derivatives HOFFMANN-LA ROCHE INC. 2006-07-20 US claimed
WO-2006074884-A1 THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2006-07-20 WO claimed
US-6469172-B2 2-AMINO-6-((4-AMINOPIPERIDIN-1-YL)METHYL)PYRIDINE; CHEMICAL INTERMEDIATE FOR MUSCARINIC M3 RECEPTOR ANTAGONISTS; ACYLATION OF 2-AMINO-6-BROMOPYRIDINE WITH TRIMETHYLACETIC ACID MERCK & CO., INC. 2002-10-22 US claimed
US-20010051727-A1 Process for the preparation of chemical compounds MERCK& CO., INC. 2001-12-13 US claimed