SCHEMBL3104313

SCHEMBL3104313

C#CC(C)(C)O[C]=O

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
SCHEMBL4796430 0.75
SCHEMBL1447663 0.71
SCHEMBL8751772 0.70
SCHEMBL28240029 0.69
SCHEMBL3101539 0.69
SCHEMBL2106177 0.69 ELANE (0.46)
SCHEMBL2104500 0.69 ELANE (0.46)
SCHEMBL3101181 0.69
SCHEMBL1670 0.67
SCHEMBL754334 0.67 TDP1 (0.31)

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-4962104-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-10-09 US claimed
US-20210106679-A1 Silaffin Silica Particle Adjuvant Universität Wien (AT) 2021-04-15 US disclosed
EP-3612216-A1 SILAFFIN SILICA PARTICLE ADJUVANT Universität Wien (AT) 2020-02-26 EP disclosed
WO-2018193039-A1 SILAFFIN SILICA PARTICLE ADJUVANT Universität Wien (AT) 2018-10-25 WO disclosed
EP-3262058-A1 A COMPOUND FOR PREPARING POLYPEPTIDES Universität Wien (AT) 2018-01-03 EP disclosed
EP-2704246-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION, ELECTRICAL STORAGE DEVICE UTILIZING SAME, AND CYCLIC SULFONIC ACID ESTER COMPOUND UBE INDUSTRIES (JP) 2017-08-23 EP disclosed
US-9608287-B2 Non-aqueous electrolytic solution, electrical storage device utilizing same, and cyclic sulfonic acid ester compound UBE INDUSTRIES, LTD. (JP) 2017-03-28 US disclosed
EP-2701230-B1 NON-AQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING THE SAME, AND TRIFLUOROMETHYLBENZENE COMPOUND UBE INDUSTRIES (JP) 2016-11-23 EP disclosed
US-9472828-B2 Nonaqueous electrolyte solution, electricity storage device using same, and trifluoromethylbenzene compound UBE INDUSTRIES, LTD. (JP) 2016-10-18 US disclosed
WO-2016135071-A1 A COMPOUND FOR PREPARING POLYPEPTIDES Universität Wien (AT) 2016-09-01 WO disclosed
EP-0027260-B1 PEPTIDES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-13 EP disclosed
US-4504584-A PEPTIDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-12 US disclosed
US-4487763-A BACTERICIDE, FUNGICIDE, ANTIBODY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-12-11 US disclosed
EP-0123442-A1 Improvements in or relating to a process for producing beta-lactam compounds THE UNIVERSITY OF NOTRE DAME DU LAC (US) 1984-10-31 EP disclosed
US-4458078-A SYNTHESIS OF OLIGOPEPTIDES FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1984-07-03 US disclosed
US-4354966-A Peptides, process for preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-10-19 US disclosed
US-4311640-A ANTIBIOTIC FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-01-19 US disclosed
EP-0027260-A2 Peptides, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-22 EP disclosed
EP-0025842-A2 Peptides, process for their preparation, their pharmaceutical compositions and their intermediates FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-01 EP disclosed
US-4214094-A ANTILIPEMIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-07-22 US disclosed