SCHEMBL50459

SCHEMBL50459

[CH2]C(=O)OCCCC

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
SCHEMBL232653 0.92
SCHEMBL23215825 0.91 ALDH1A1 (0.52)
SCHEMBL8893832 0.90 NAAA (0.61)
SCHEMBL5733798 0.90 NAAA (0.61)
SCHEMBL3015647 0.90 NAAA (0.61)
SCHEMBL8915954 0.90 NAAA (0.61)
SCHEMBL4363618 0.90 NAAA (0.61)
SCHEMBL3034401 0.90 NAAA (0.61)
SCHEMBL4653423 0.90 NAAA (0.61)
SCHEMBL8356788 0.90 NAAA (0.61)

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

Appears in 3492 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230131260-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US claimed
US-20220184165-A1 Novel Compounds and Pharmaceutical Preparations DICOT AB (SE) 2022-06-16 US claimed
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents SYNGENTA CROP PROTECTION AG (CH) 2022-03-15 US claimed
EP-3728235-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP claimed
EP-3728237-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP claimed
US-11088380-B2 Electrolyte solution for redox flow battery and redox flow battery comprising same SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2021-08-10 US claimed
US-20210087151-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2021-03-25 US claimed
CN-108008600-B Radiation-sensitive composition 三菱瓦斯化学株式会社 2021-02-09 CN claimed
CN-112218860-A Substituted phenylthiouracils, their salts and their use as herbicides 先正达农作物保护股份公司 2021-01-12 CN claimed
CN-112154147-A Substituted phenylthiouracils, their salts and their use as herbicides 先正达农作物保护股份公司 2020-12-29 CN claimed
CN-1067657-A The preparation method of 'beta '-lactam compounds BEECHAM GROUP PLC (GB) 1993-01-06 CN claimed
WO-1992004336-A1 INTERMEDIATES FOR CHELATING AGENTS WITH PREFIXED SYMMETRY AND PROCESS FOR THEIR PREPARATION BRACCO INDUSTRIA CHIMICA S.P.A. (IT) 1992-03-19 WO claimed
US-4960873-A 3-pyridylisothiazoleazo compounds useful as disperse dyes BASF AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
US-4898850-A YELLOW PATTERNS OR IMAGES ON POLYMERIC COATED PAPER SHEETS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1990-02-06 US claimed
EP-0268963-A1 Benzazolylthio-carbapenem antibiotics BAYER AG (DE) 1988-06-01 EP claimed
EP-0040898-B1 2-NITRO-5-(SUBSTITUTED-PHENOXY) BENZOATE ESTERS OF ALPHA-HYDROXYALKANOATES AND METHODS OF USING SAME AS HERBICIDES RHONE-POULENC AGROCHIMIE (FR) 1985-01-16 EP claimed
US-4248886-A Combating fungi with N-oxalyl-N-phenyl-aminoacids and esters thereof BAYER AKTIENGESELLSCHAFT (DE) 1981-02-03 US claimed
EP-0006693-A1 N-substituted trialkylstannylhydrocarbylcarboxylic acid hydrazides, methods of their preparation and insecticide compositions containing them UNIROYAL, INC. (US) 1980-01-09 EP claimed
US-4178382-A INSECTICIDE FOR COTTON UNIROYAL, INC. (US) 1979-12-11 US claimed
US-4053469-A BACTERICIDES SHIONOGI & CO., LTD. (JA) 1977-10-11 US claimed