SCHEMBL95061

SCHEMBL95061

O=[C]OCCCl

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
SCHEMBL7571482 0.86 ALDH1A1 (0.31)
SCHEMBL7568686 0.86
SCHEMBL97141 0.84
SCHEMBL97256 0.82
SCHEMBL6573282 0.81
SCHEMBL5540901 0.80 ALDH1A1 (0.33)
SCHEMBL14480100 0.80
SCHEMBL5541009 0.80 ALDH1A1 (0.33)
SCHEMBL5545958 0.80 ALDH1A1 (0.33)
SCHEMBL5540404 0.80 ALDH1A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118125950-A Chiral alpha-amino acid derivative and preparation method and application thereof 四川大学 2024-06-04 CN claimed
WO-2012145932-A1 A NOVEL PROCESS FOR THE PREPARATION OF PERAMIVIR AND INTERMEDIATES THEREOF PHARMARESOURCES (SHANGHAI) CO., LTD. (CN) 2012-11-01 WO claimed
WO-2011073277-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS Kv1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO claimed
WO-2011073273-A1 BENZOXAZINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO claimed
US-7488741-B2 4-Aminopiperidine derivatives, processes for their preparation and their use as medicaments UCB PHARMA, S.A. (BE) 2009-02-10 US claimed
EP-1501801-B1 2,6-QUINOLINYL AND 2,6-NAPHTHYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF VLA-4 DEPENDENT DISEASES UCB PHARMA SA (BE) 2008-01-23 EP claimed
EP-0640077-B1 OXAZOLIDINONES CONTAINING A SUBSTITUTED DIAZINE MOIETY AND THEIR USE AS ANTIMICROBIALS UPJOHN CO (US) 2002-06-26 EP claimed
CN-1044236-C Oxazolidinone antimicrobials containing substituted diazine moieties PHARMACIA UPJOHN CO (US) 1999-07-21 CN claimed
US-5798311-A INSECTICIDES ROHM AND HAAS COMPANY (US) 1998-08-25 US claimed
US-5723409-A Intermediates for the preparation of phenylsulfonylurea herbicides and plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 1998-03-03 US claimed
EP-0413221-A2 Selective herbicides based on sulfonylisothioureas BAYER AG (DE) 1991-02-20 EP claimed
EP-0362634-A2 Basic dihydropyridines, process for their preparation and their use as intermediates BAYER AG (DE) 1990-04-11 EP claimed
US-4843068-A INSECTICIDES, MITICIDES, FUNGICIDES NIHON NOHYAKU CO., LTD. (JP) 1989-06-27 US claimed
US-4818748-A HYPOTENSIVE AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1989-04-04 US claimed
CN-86108691-A Pyrazole oxime derivatives, process for their preparation and their use NIHON NOHYAKU CO LTD (JP) 1988-01-20 CN claimed
EP-0236874-A2 Renin inhibitors, their production and use, as well as derivatives of amino acids and amino aldehydes BAYER AG (DE) 1987-09-16 EP claimed
EP-0234045-A2 A pyrazole oxime derivative and its production and use NIHON NOHYAKU CO., LTD. (JP) 1987-09-02 EP claimed
US-4284634-A HYPOTENSIVE VASODILATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-08-18 US claimed
US-4267317-A CONCURRENT ETHERIFICATION AND DEHYDROGENATION OF A PHENOL BY REACTING WITH A 1-CARBOXY-3-HALOALKANE USING AN ALKALI METAL COMPOUND AND A SPECIAL SOLVENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1981-05-12 US claimed
US-4222767-A Certain herbicidal sulfonates and sulfamates FISONS LIMITED (GB) 1980-09-16 US claimed