SCHEMBL7901665

SCHEMBL7901665

[N-]=[N+]=NOS(=O)(=O)C(F)(F)F

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
SCHEMBL693830 0.71
SCHEMBL8363499 0.70
SCHEMBL2744267 0.69 CA1 (0.33)
SCHEMBL2319750 0.67
SCHEMBL215513 0.67 CA1 (0.32)
SCHEMBL28255346 0.66 CA2 (0.37)
SCHEMBL6325095 0.62
SCHEMBL27725055 0.62
SCHEMBL14712451 0.62 F2 (0.30)
SCHEMBL7547616 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0427694-B1 Synthesis of mannojirimycin derivatives MONSANTO CO (US) 1994-05-04 EP claimed
EP-0427694-A1 Synthesis of mannojirimycin derivatives MONSANTO COMPANY (US) 1991-05-15 EP claimed
US-5011929-A From protected azidolactone by reduction and cyclization MONSANTO COMPANY (US) 1991-04-30 US claimed
JP-3127775-A None JP disclosed
CN-114437157-A Sialic acid Neu5Ac derivative and preparation method and application thereof 深圳先进技术研究院 2022-05-06 CN disclosed
US-10351591-B2 Polypeptides, peptides, and proteins functionalized by alkylation of thioether groups via ring-opening reactions THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-07-16 US disclosed
US-20180105553-A1 POLYPEPTIDES, PEPTIDES, AND PROTEINS FUNCTIONALIZED BY ALKYLATION OF THIOETHER GROUPS VIA RING-OPENING REACTIONS NATIONAL SCIENCE FOUNDATION 2018-04-19 US disclosed
WO-2016154120-A1 POLYPEPTIDES, PEPTIDES, AND PROTEINS FUNCTIONALIZED BY ALKYLATION OF THIOETHER GROUPS VIA RING-OPENING REACTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-09-29 WO disclosed
EP-2710027-A1 BOMBESIN RECEPTOR TARGETING PEPTIDE INCORPORATING A 1, 2, 3-TRIAZOLE GROUP IN THE BACKBONE FOR PREPARING IN VIVO DIAGNOSTIC AND THERAPEUTIC AGENTS Universitätsspital Basel (CH) 2014-03-26 EP disclosed
WO-2012156511-A1 BOMBESIN RECEPTOR TARGETING PEPTIDE INCORPORATING A 1, 2, 3-TRIAZOLE GROUP IN THE BACKBONE FOR PREPARING IN VIVO DIAGNOSTIC AND THERAPEUTIC AGENTS UNIVERSITÄTSSPITAL BASEL (CH) 2012-11-22 WO disclosed
US-6197963-B1 TETRAHYDROPYRAN DERIVATIVES; PROTEIN G, SOMATOSTATIN, AND NATURAL KILLER CELL RECEPTOR ANTAGONISTS OR MIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2001-03-06 US disclosed
US-5075448-A Synthesis of swainsonine and analogs thereof MONSANTO COMPANY (US) 1991-12-24 US disclosed
US-5023340-A Pyrrolizioines and synthesis thereof MONSANTO COMPANY (US) 1991-06-11 US disclosed
US-5021562-A Chemical intermediates MONSANTO COMPANY (US) 1991-06-04 US disclosed
JP-H03127775-A SYNTHESIS OF MANNOJIRIMYCIN DERIVATIVE MONSANTO CO 1991-05-30 JP disclosed
EP-0427693-A1 Method for azide displacement of alpha-triflates of 1,5-lactones MONSANTO COMPANY (US) 1991-05-15 EP disclosed
EP-0427694-A1 Synthesis of mannojirimycin derivatives MONSANTO COMPANY (US) 1991-05-15 EP disclosed
US-5011929-A From protected azidolactone by reduction and cyclization MONSANTO COMPANY (US) 1991-04-30 US disclosed
EP-0424349-A1 Synthesis of 1,4-dideoxy-1,4-imino-D-mannitol MONSANTO COMPANY (US) 1991-04-24 EP disclosed
EP-0423099-A1 Synthesis of nojirimycin derivatives Monsanto Company (US) 1991-04-17 EP disclosed