SCHEMBL305360

SCHEMBL305360

[CH2]OC(=O)CC(C)C

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
SCHEMBL15689755 0.81
SCHEMBL5764417 0.77
SCHEMBL7054842 0.77
SCHEMBL5424411 0.77 ALDH1A1 (0.50)
SCHEMBL248143 0.77 ALDH1A1 (0.50)
SCHEMBL2257580 0.75 BLM (0.47)
SCHEMBL1291029 0.74
SCHEMBL11695076 0.74
SCHEMBL16996650 0.74 MMP1 (0.48)
SCHEMBL112862 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112624969-A Quinoline derivative, preparation method thereof and application thereof in preventing and treating plant viruses and killing bacteria 南开大学 2021-04-09 CN claimed
EP-2189443-B1 TRICYCLIC AMIDE COMPOUND RES FOUND ITSUU LAB (JP) 2013-10-23 EP claimed
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP claimed
US-20110152166-A1 METHOD OF MODULATION OF PROTEIN PHOSPHORYLATION-DEPENDENT CONFORMATIONAL TRANSITIONS WITH LOW MOLECULAR WEIGHT COMPOUNDS Biondi, Ricardo M. (DE) 2011-06-23 US claimed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP claimed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US claimed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US claimed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US claimed
EP-2057280-A2 METHOD OF MODULATION OF PROTEIN PHOSPHORYLATION-DEPENDENT CONFORMATIONAL TRANSITIONS WITH LOW MOLECULAR WEIGHT COMPOUNDS Biondi, Ricardo, Miguel (DE) 2009-05-13 EP claimed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US claimed
US-5589594-A AMIDATION OF 7-AMINOCEPH-3-EM-4-CARBOXYLIC ESTER USING AMINOTHIAZOLE OXIME CARBOXYLIC ACID WITH REMOVAL OF PROTECTING GROUP BY ACID HYDROLYSIS AND CLEAVAGE OF DISULFIDE HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-31 US claimed
US-5389625-A Sweet taste; oral administering KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-02-14 US claimed
EP-0555769-A2 Process for the preparation of Cephem-Prodrug-esters HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-18 EP claimed
EP-0497978-A1 CEPHALOSPORIN COMPOUNDS AND PRODUCTION THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 1992-08-12 EP claimed
US-5036063-A Penem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-30 US claimed
EP-0373388-A2 Penem derivatives and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-20 EP claimed
EP-0307872-A2 Esters of amino-acids, process for their preparation, medicaments containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-03-22 EP claimed
US-4446317-A CEFUROXIME ESTERS GLAXO OPERATIONS U.K. LIMITED (GB) 1984-05-01 US claimed
US-4420478-A ANTIBIOTICS, BACTERICIDES, CEPHALOSPORINS ROUSSEL UCLAF (FR) 1983-12-13 US claimed
US-4287193-A ANTIBIOTIC DERIVATIVES OF CEPHALOSPORANIC ACID ROUSSEL UCLAF (FR) 1981-09-01 US claimed