SCHEMBL853354

SCHEMBL853354

[O-][n+]1ccccc1Cl

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
SCHEMBL29882164 1.00
Hydrochloric Acid SCHEMBL852482 0.97
Dimethyl Sulfoxide SCHEMBL8884732 0.89 LMNA (0.40)
2-Chloropyridine SCHEMBL1647164 0.82 TDP1 (0.59)
SCHEMBL29727517 0.71 LMNA (0.52)
SCHEMBL871319 0.71 LMNA (0.52)
SCHEMBL2384022 0.69
SCHEMBL1425201 0.69
SCHEMBL904632 0.69
SCHEMBL4934007 0.67 SLC22A2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059054-A1 PROCESS FOR PREPARING (2S,4S,4'S,6S)-2-METHYL-6-(1-METHYL-1H-1,2,3-TRIAZOL-4-YL)-2',-(TRIELUOROMETHYL)-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO [2,3-C] PYRAN] -4'-OL VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-03-20 WO claimed
CN-118724805-B Method for preparing pyridine N-oxide in large scale under mild condition 山东仁一生物科技有限责任公司 2024-11-01 CN claimed
CN-118724805-A Method for preparing pyridine N-oxide in large scale under mild condition 山东仁一生物科技有限责任公司 2024-10-01 CN claimed
CN-118345390-A Method for preparing carbonyl compound by electrocatalytic oxidation of benzyl C-H bond by pyridine nitrogen oxide 浙江大学 2024-07-16 CN claimed
WO-2024124905-A1 METHOD FOR SYNTHESIZING 2-HYDROXYPYRIDINE-N OXIDE 黄冈鲁班药业股份有限公司 2024-06-20 WO claimed
CN-113832484-B Preparation method of shampoo anti-dandruff antipruritic 广州唯我美日用品有限公司 2023-12-08 CN claimed
CN-116903529-A Method and equipment for preparing sodium pyrithione 无锡锡惠检测技术有限公司 2023-10-20 CN claimed
CN-113749984-B Preparation method of shampoo composition 戴云 2023-06-02 CN claimed
CN-113730278-B Anti-dandruff itching-relieving shampoo 浙江领康企业管理有限公司 2023-05-16 CN claimed
CN-116082229-A Synthesis method of 2-hydroxypyridine-N oxide 黄冈鲁班药业股份有限公司 2023-05-09 CN claimed
US-4533736-A ALKALI METAL SULFITES, BISULFITES OR HYDRAZINE AS REDUCING AGENTS OLIN CORPORATION (US) 1985-08-06 US claimed
EP-0029917-B1 INDICATOR COMPOSITION AND TEST DEVICE CONTAINING AMINE OXIDE MILES LABORATORIES, INC. (US) 1985-02-20 EP claimed
US-4490532-A Synthesis of 2-[1-(2,5-dimethylphenyl)ethylsulfonyl]pyridine-1-oxide herbicide and intermediates therefor UNIROYAL LTD. (CA) 1984-12-25 US claimed
US-4396766-A Process for producing sodium and zinc pyrithione OLIN CORPORATION (US) 1983-08-02 US claimed
US-4318984-A COMPRISING A PEROXIDASE, A SUGAR OXIDASE AND A CHROMOGEN AND AN OXYGEN FUNCTIONAL GROUP COMPOUND AS EXHANCER MILES LABORATORIES, INC. (US) 1982-03-09 US claimed
EP-0044647-A2 Synthesis of a pyridine-1-oxide herbicide and intermediates therefor UNIROYAL LIMITED (CA) 1982-01-27 EP claimed
US-4279993-A CHROMOGENIC BENZIDINE-TYPE INDICATORS WITH PEROXIDE REACTANT MAGERS THOMAS A 1981-07-21 US claimed
EP-0029917-A1 Indicator composition and test device containing amine oxide MILES LABORATORIES, INC. (US) 1981-06-10 EP claimed
US-4000047-A PYRIDINE OR QUINOLINE COMPOUND BRIGHTENERS LEA-RONAL, INC. (US) 1976-12-28 US claimed
US-3954781-A BY REACTING 2-MERCAPTOPYRIDINE-1-OXIDE WITH IN SITU GENERATED HYPOCHLOROUS ACID OLIN CORPORATION (US) 1976-05-04 US claimed