SCHEMBL891864

SCHEMBL891864

Cc1cc(C)c[n+]([O-])c1

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
SCHEMBL27997117 0.81
SCHEMBL11956554 0.74 LMNA (0.39)
SCHEMBL2857259 0.69
SCHEMBL27695794 0.69 ALDH1A1 (0.61)
SCHEMBL2380926 0.69 ALDH1A1 (0.61)
Water SCHEMBL10801365 0.67 ALDH1A1 (0.35)
SCHEMBL417479 0.67
SCHEMBL4446588 0.67
SCHEMBL9750721 0.67
Iodide SCHEMBL10798974 0.67 ACHE (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-114426823-B Oil field insoluble scale dispersing solubilizer and preparation method thereof 中国石油化工股份有限公司 2022-12-30 CN claimed
CN-114426823-A Oil field insoluble scale dispersing solubilizer and preparation method thereof 中国石油化工股份有限公司 2022-05-03 CN claimed
CN-111058069-A Plating solution for electroplating tin alloy 上村工业株式会社 2020-04-24 CN claimed
US-20200123673-A1 ELECTROLYTIC TIN ALLOY PLATING SOLUTION C. UYEMURA & CO., LTD. (JP) 2020-04-23 US claimed
CN-104557693-B A kind of synthetic method of 3,5-Dimethyl-4-nitropyridine-N-oxide 江苏中邦制药有限公司 2017-01-04 CN claimed
CN-104557693-A Synthesis method of 3,5-dimethyl-4-nitropyridine-N-oxide JIANGSU ZHONGBANG PHARMACEUTICAL CO LTD 2015-04-29 CN claimed
CN-101648910-A Method for preparing 3,5-dimethylpyridine-N-oxide NANJING NO 1 PESTICIDE GROUP C 2010-02-17 CN claimed
US-6245913-B1 OXIDATION OF LUTIDINE; EASIER PURIFICATION WOCKHARDT EUROPE LIMITED (IE) 2001-06-12 US claimed
US-12600728-B2 Interleukin-17 inhibitors NOVARTIS AG (CH) 2026-04-14 US disclosed
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 disclosed
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 disclosed
US-20230391752-A1 PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AND RELATED USES CHULALONGKORN UNIVERSITY (TH) 2023-12-07 US disclosed
US-20230391782-A1 INTERLEUKIN-17 INHIBITORS NOVARTIS AG (CH) 2023-12-07 US disclosed
EP-0048174-B1 PROCESS FOR PRODUCING VINYL ACETATE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1984-02-22 EP disclosed
EP-0065817-A1 Process for producing carboxylic acids MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-12-01 EP disclosed
EP-0055622-A1 Process for producing acetic anhydride MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-07-07 EP disclosed
EP-0048174-A1 Process for producing vinyl acetate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-03-24 EP disclosed
EP-0035860-A2 Process for producing ethylidene diacetate and/or acetaldehyde MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1981-09-16 EP disclosed