SCHEMBL248788

SCHEMBL248788

CC(C)OC(=O)C=[N+]=[N-]

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
SCHEMBL10620516 0.76 HCAR2 (0.56)
SCHEMBL31463337 0.76 CTSK (0.34)
SCHEMBL28601118 0.73
SCHEMBL332010 0.72
SCHEMBL334886 0.71 ALDH1A1 (0.35)
SCHEMBL809218 0.71 TSHR (0.55)
SCHEMBL177748 0.71 HCAR2 (0.80)
SCHEMBL177747 0.71 HCAR2 (0.80)
SCHEMBL178194 0.71 HCAR2 (0.80)
SCHEMBL9398022 0.70 HCAR2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250092008-A1 PROCESS FOR MAKING AN EP4 ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2025-03-20 US claimed
CN-118930436-A Method for catalyzing coupling reaction of nitro compound and diazo compound by using corrinyl ring-containing small molecular compound 北京化工大学 2024-11-12 CN claimed
EP-4384509-A1 PROCESS FOR MAKING AN EP4 ANTAGONIST ONO Pharmaceutical Co., Ltd. (JP) 2024-06-19 EP claimed
WO-2023017813-A1 PROCESS FOR MAKING AN EP4 ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2023-02-16 WO claimed
CN-107118171-B A kind of preparation method of isoxazoline derivative 苏州大学 2019-05-17 CN claimed
CN-106831764-B A kind of Indoli zine derivatives and preparation method thereof 苏州大学 2018-11-02 CN claimed
CN-106831764-A A kind of Indoli zine derivatives and preparation method thereof 苏州大学 2017-06-13 CN claimed
US-20130165696-A1 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR ACTAVIS GROUP PTC EHF (IS) 2013-06-27 US claimed
EP-2588441-A2 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR Actavis Group Ptc Ehf (IS) 2013-05-08 EP claimed
WO-2012001531-A2 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR ACTAVIS GROUP PTC EHF (IS) 2012-01-05 WO claimed
CN-101538226-A Method for synthesizing optically active alpha-hydroxyl-beta-phenmethyl-beta-amino acid derivative UNIV EAST CHINA NORMAL 2009-09-23 CN claimed
CN-1109018-C Systhesis of hydrazone beta-keto ester by reaction with diazo ester MONSANTO CO (US) 2003-05-21 CN claimed
CN-1234021-A Synthesis of a hydrazone beta-ketoester by reaction with a diazo ester MONSANTO CO (US) 1999-11-03 CN claimed
US-12466850-B2 Method for producing peptide compound NISSAN CHEMICAL CORPORATION (JP) 2025-11-11 US disclosed
US-20250092008-A1 PROCESS FOR MAKING AN EP4 ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2025-03-20 US disclosed
CN-118930436-A Method for catalyzing coupling reaction of nitro compound and diazo compound by using corrinyl ring-containing small molecular compound 北京化工大学 2024-11-12 CN disclosed
EP-1593674-A1 OPTICALLY ACTIVE BISOXAZOLINE COMPOUNDS, PROCESS FOR PRODUCTION OF THE SAME AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2005-11-09 EP disclosed
EP-1038866-B1 Process for producing aziridine compound DAICEL CHEM (JP) 2003-11-12 EP disclosed
US-6323346-B1 REACTING A DIAZOACETIC ACID DERIVATIVE OF THE FORMULA N.SUB.2 CHR.SUP.4 WITH A CARBONYL COMPOUND OF FORMULA R.SUP.1 R.SUP.2 C.DBD.O AND AN AMINO-GROUP-CONTAINING COMPOUND OF FORMULA R.SUP.3 NH.SUB.2 IN THE PRESENCE OF AN IRIDIUM COMPLEX DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-11-27 US disclosed
EP-1038866-A1 Process for producing aziridine compound Daicel Chemical Industries, Ltd. (JP) 2000-09-27 EP disclosed