SCHEMBL989518

SCHEMBL989518

O=C(O)C(CS)C1CC1

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
SCHEMBL2079843 0.98 CPN1 (0.70)
SCHEMBL25389365 0.91 CPN1 (0.68)
SCHEMBL2353967 0.85 CPN1 (1.00)
SCHEMBL9063708 0.78
SCHEMBL2354051 0.78 CPN1 (1.00)
SCHEMBL3179113 0.77
SCHEMBL2349599 0.76 CPN1 (1.00)
SCHEMBL2352986 0.76 CPN1 (1.00)
Lithium Ion SCHEMBL4370616 0.76 CPN1 (0.47)
SCHEMBL11369626 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598781-B Preparation method of key intermediate of montelukast sodium 迪嘉药业集团股份有限公司 2025-06-10 CN claimed
CN-118598781-A Preparation method of key intermediate of montelukast sodium 迪嘉药业集团股份有限公司 2024-09-06 CN claimed
CN-114181121-B Preparation method of 1-mercaptomethyl cyclopropylacetic acid 江苏阿尔法药业股份有限公司 2024-04-26 CN claimed
CN-114591140-B Montelukast sodium intermediate, preparation method thereof and preparation method using intermediate 江苏阿尔法药业股份有限公司 2024-04-19 CN claimed
CN-116332816-A Method for preparing 1-mercaptomethyl cyclopropylacetic acid by one-step method 江苏阿尔法药业股份有限公司 2023-06-27 CN claimed
CN-113337857-B Acidic sulfate copper electroplating combined additive for thickening PCB through hole metal 厦门大学 2022-06-21 CN claimed
CN-113337857-A Acidic sulfate copper electroplating combined additive for thickening PCB through hole metal 厦门大学 2021-09-03 CN claimed
CN-112094212-A Preparation method of montelukast sodium side chain 宿迁盛基医药科技有限公司 2020-12-18 CN claimed
US-20130045391-A1 Tarnish Inhibiting Composition for Metal Leadframes MACDERMID ACUMEN, INC. 2013-02-21 US claimed
WO-2011004298-A1 MONTELUKAST HEXAMETHYLENEDIAMINE SALT AND ITS USE FOR THE PREPARATION OF MONTELUKAST SODIUM ALEMBIC LIMITED (IN) 2011-01-13 WO claimed
WO-2007088545-A2 NOVEL PROCESS FOR PREPARING 1-(MERCAPTOMETHYL) CYCLOPROPANEACETIC ACID, A USEFUL INTERMEDIATE IN THE PREPARATION OF MONTELUKAST AND SALTS THEREOF CHEMAGIS LTD. (IL) 2007-08-09 WO claimed
EP-1474386-A1 PROCESS FOR THE PREPARATION OF 1-(MERCAPTOMETHYL)-CYCLOPROPANEACETIC ACID Delmar Chemicals Inc. (CA) 2004-11-10 EP claimed
WO-2003066582-A1 PROCESS FOR THE PREPARATION OF 1-(MERCAPTOMETHYL)-CYCLOPROPANEACETIC ACID DELMAR CHEMICALS INC. (CA) 2003-08-14 WO claimed
EP-0805808-A1 PROCESS FOR THE PREPARATION OF 1-(THIOMETHYL)-CYCLOPROPANEACETIC ACID Merck & Co., Inc. (US) 1997-11-12 EP claimed
EP-0737186-A1 PROCESS FOR THE PREPARATION OF LEUKOTRIENE ANTAGONISTS MERCK & CO. INC. (US) 1996-10-16 EP claimed
WO-1996022987-A1 PROCESS FOR THE PREPARATION OF 1-(THIOMETHYL)-CYCLOPROPANEACETIC ACID MERCK & CO., INC. (US) 1996-08-01 WO claimed
WO-1995018107-A1 PROCESS FOR THE PREPARATION OF LEUKOTRIENE ANTAGONISTS MERCK & CO., INC. (US) 1995-07-06 WO claimed
CN-121378126-A Preparation method of montelukast sodium 艾美科健(中国)生物医药有限公司 2026-01-23 CN disclosed
US-5523477-A REACTING 1,1-CYCLOPROPANEDIMETHANOL WITH DIALKYL SULFITE IN PRESENCE OF ACID OR BASE TO FORM CYCLIC SULFITE, REMOVING ALCOHOL REACTION BY-PRODUCT MERCK & CO., INC. (US) 1996-06-04 US disclosed
WO-1995018107-A1 PROCESS FOR THE PREPARATION OF LEUKOTRIENE ANTAGONISTS MERCK & CO., INC. (US) 1995-07-06 WO disclosed