SCHEMBL175899

SCHEMBL175899

C=CCOC(=O)C(=O)Cl

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
SCHEMBL29220213 0.85 CYP3A4 (0.42)
SCHEMBL177943 0.84 CYP3A4 (0.48)
SCHEMBL244797 0.83
SCHEMBL7512684 0.81 CYP3A4 (0.46)
SCHEMBL37486 0.81
SCHEMBL27546354 0.81 CYP3A4 (0.46)
SCHEMBL27651936 0.79 CYP3A4 (0.38)
SCHEMBL11070215 0.79 CYP3A4 (0.38)
SCHEMBL7478595 0.79
SCHEMBL10966895 0.79 CYP3A4 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111278832-B Isodianhydrohexide-bisoxalate compound, polymer thereof and application thereof 科学与工业研究委员会 2024-04-12 CN claimed
US-20210147438-A1 AN ISOHEXIDE-DIOXALATE COMPOUND, ITS POLYMERS AND APPLICATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-05-20 US claimed
CN-111278832-A Isodianhydrohexitol-oxalate compound, polymer thereof and use thereof 科学与工业研究委员会 2020-06-12 CN claimed
EP-3652181-A1 AN ISOHEXIDE-DIOXALATE COMPOUND, ITS POLYMERS AND APPLICATION THEREOF Council of Scientific and Industrial Research (IN) 2020-05-20 EP claimed
WO-2019012560-A1 AN ISOHEXIDE-DIOXALATE COMPOUND, ITS POLYMERS AND APPLICATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-01-17 WO claimed
US-5215997-A Synthesis of beta-lactam compounds CIBA-GEIGY CORPORATION (US) 1993-06-01 US claimed
EP-0292230-B1 PHENYLACETIC ACID DERIVATIVES AND THEIR USE IN THE PREPARATION OF CEPHALOSPORIN ANTIBIOTICS AJINOMOTO CO., INC. (JP) 1992-01-22 EP claimed
EP-0292230-A2 Phenylacetic acid derivatives and their use in the preparation of cephalosporin antibiotics AJINOMOTO CO., INC. (JP) 1988-11-23 EP claimed
EP-0058317-B1 PROCESS FOR THE PREPARATION OF 2-PENEM COMPOUNDS SCHERING CORPORATION (US) 1986-08-27 EP claimed
US-4347183-A Process for the synthesis of penems and carbapenems SCHERING CORPORATION (US) 1982-08-31 US claimed
EP-0058317-A1 Process for the preparation of 2-penem compounds SCHERING CORPORATION (US) 1982-08-25 EP claimed
JP-8073425-A None JP disclosed
EP-4389263-A1 SUBSTITUTED TRIANGLAMINE AND USES THEREOF Centre national de la recherche scientifique (FR) 2024-06-26 EP disclosed
EP-4380939-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS Fileclo Spolka Z Ograniczona Odpowiedzialnoscia (PL) 2024-06-12 EP disclosed
EP-3523309-B1 ANTIBACTERIAL AGENTS AGAINST D,D- AND L,D-TRANSPEPTIDASES UNIV JOHNS HOPKINS (US) 2024-04-17 EP disclosed
US-4374844-A BACTERICIDES SCHERING CORPORATION (US) 1983-02-22 US disclosed
EP-0063411-A1 Substituted methanephoshonic acid derivatives, their use as herbicides, herbicidal compositions containing them, and processes for preparing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-10-27 EP disclosed
US-4347183-A Process for the synthesis of penems and carbapenems SCHERING CORPORATION (US) 1982-08-31 US disclosed
EP-0058317-A1 Process for the preparation of 2-penem compounds SCHERING CORPORATION (US) 1982-08-25 EP disclosed
US-4248886-A Combating fungi with N-oxalyl-N-phenyl-aminoacids and esters thereof BAYER AKTIENGESELLSCHAFT (DE) 1981-02-03 US disclosed