SCHEMBL503712

SCHEMBL503712

COc1cc[n+]([O-])cc1

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
Water SCHEMBL15952817 0.97 CA1 (0.50)
Water SCHEMBL665693 0.97 CA1 (0.50)
SCHEMBL4100152 0.85 ESR2 (0.52)
SCHEMBL18154523 0.80 APP (0.61)
SCHEMBL10256951 0.74
SCHEMBL2328649 0.72 CA1 (0.61)
SCHEMBL7950793 0.72
SCHEMBL18517016 0.72
SCHEMBL785785 0.72 NQO1 (0.59)
1,4-Dimethoxybenzene SCHEMBL8489 0.71 CA1 (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3484971-B1 ALTERNATIVE OXIDIZING AGENTS FOR COBALT CHEMICAL-MECHANICAL POLISHING CMC MAT LLC (US) 2025-08-27 EP claimed
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-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
CN-117303995-A Method for preparing high-tension quaternary cycloalkane fuel by cyclic ketone or cyclic alcohol one-pot method and application of fuel 西北工业大学重庆科创中心 2023-12-29 CN claimed
CN-116444370-A Preparation method of alpha, beta-unsaturated carboxylic acid derivative 大连理工常熟研究院有限公司 2023-07-18 CN claimed
CN-113896646-B Efficient green preparation method of 4-methyl-3-oxo-N-phenyl valeramide 浙江海森药业股份有限公司 2023-06-02 CN claimed
CN-109415599-B Alternative oxidizing agents for cobalt chemical mechanical polishing CMC材料股份有限公司 2022-09-27 CN claimed
CN-216727197-U Reaction cooling equipment for preparing 4-methoxypyridine-N-oxide 济南泺合医药技术有限公司 2022-06-14 CN claimed
CN-113896646-A Efficient green preparation method of 4-methyl-3-oxo-N-phenyl valeramide 上海华理生物医药股份有限公司 2022-01-07 CN claimed
CN-111058069-A Plating solution for electroplating tin alloy 上村工业株式会社 2020-04-24 CN claimed
EP-0576622-B1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK CO (US) 1997-11-05 EP claimed
EP-0801652-A2 TRIBOLUMINESCENT LANTHANIDE III COMPLEXES Ciba SC Holding AG (CH) 1997-10-22 EP claimed
WO-1997014668-A9 OXIDATION OF ALDEHYDES TO CARBOXYLIC ACIDS 1997-08-07 WO claimed
WO-1997014668-A1 OXIDATION OF ALDEHYDES TO CARBOXYLIC ACIDS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-04-24 WO claimed
WO-1997014669-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE CARBOXYLIC ACIDS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-04-24 WO claimed
WO-1996020942-A2 TRIBOLUMINESCENT LANTHANIDEIII COMPLEXES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1996-07-11 WO claimed
EP-0576622-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1994-01-05 EP claimed
WO-1992017821-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1992-10-15 WO claimed
US-5141839-A LITHOGRAPHIC PRINTING PLATES HAVING A RADIATION-SENSITIVE LAYER COMPRISING A PHOTOCROSSLINKABLE POLYMER, A LEUCO DYE, A PHOTOOXIDANT AND A HETEROAROMATIC AMINE N-OXIDE EASTMAN KODAK COMPANY (US) 1992-08-25 US claimed
US-5141842-A Negative working lithography printing plates EASTMAN KODAK COMPANY (US) 1992-08-25 US claimed