SCHEMBL2977955

SCHEMBL2977955

[CH2]C1([N+](=O)[O-])C=CC=CC1

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
SCHEMBL27801237 0.73
SCHEMBL365160 0.70
SCHEMBL3212979 0.70
SCHEMBL9650655 0.70
SCHEMBL3953572 0.70
SCHEMBL4254172 0.70
Ethane SCHEMBL27535133 0.70
SCHEMBL6363554 0.69
SCHEMBL28070360 0.69
Methoxymethane SCHEMBL27864187 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1855725-A2 CYCLODEXTRIN-BASED POLYMERS CONTAINING PHOTOCLEAVABLE LINKERS FOR DRUG DELIVERY Insert Therapeutics Inc. (US) 2007-11-21 EP claimed
EP-1730158-A2 METHODS AND COMPOSITIONS FOR IN VITRO AND IN VIVO USE OF PARALLEL STRANDED HAIRPINS AND TRIPLEX STRUCTURES AS NUCLEIC ACID LIGANDS Cygene, Inc. (US) 2006-12-13 EP claimed
US-20060210527-A1 Cyclodextrin-based polymers for therapeutics delivery INSERT THERAPEUTICS, INC. (US) 2006-09-21 US claimed
WO-2006089007-A2 CYCLODEXTRIN-BASED POLYMERS CONTAINING PHOTOCLEAVABLE LINKERS FOR DRUG DELIVERY INSERT THERAPEUTICS, INC. (US) 2006-08-24 WO claimed
WO-2005067437-A2 METHODS AND COMPOSITIONS FOR IN VITRO AND IN VIVO USE OF PARALLEL STRANDED HAIRPINS AND TRIPLEX STRUCTURES AS NUCLEIC ACID LIGANDS CYGENE, INC. (US) 2005-07-28 WO claimed
CN-116102565-A Isolamine-containing spirochromone compound and preparation method and application thereof 贵州大学 2023-05-12 CN disclosed
US-9625448-B2 Double caged GABA compounds, bis-CNB-GABA THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2017-04-18 US disclosed
US-20150266809-A1 DOUBLE CAGED GABA COMPOUNDS, BIS-CNB-GABA THE TRUSTEES OF PRINCETON UNIVERSITY 2015-09-24 US disclosed
EP-2186799-B1 AROMATIC SULFONIUM SALT COMPOUND ADEKA CORP (JP) 2015-07-08 EP disclosed
US-7772432-B2 Amidobenzamide derivatives which are useful as cytokine inhibitors ASTRAZENECA AB (SE) 2010-08-10 US disclosed
US-7527733-B2 Chelating agents for heavy metal removal THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-05-05 US disclosed
EP-1855725-A2 CYCLODEXTRIN-BASED POLYMERS CONTAINING PHOTOCLEAVABLE LINKERS FOR DRUG DELIVERY Insert Therapeutics Inc. (US) 2007-11-21 EP disclosed
WO-2006039235-A2 CHELATING AGENTS FOR HEAVY METAL REMOVAL UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2006-04-13 WO disclosed
US-20060065604-A1 Chelating agents for heavy metal removal THE UNIVERSITY OF SOUTHERN CALIFORNIA 2006-03-30 US disclosed
EP-1565480-A2 DETECTABLE LABELED NUCLEOSIDE ANALOGS AND METHODS OF USE THEREOF Roche Diagnostics GmbH (DE) 2005-08-24 EP disclosed
US-20050038081-A1 Amidobenzamide derivatives which are useful as cytokine inhibitors ASTRAZENECA 2005-02-17 US disclosed
WO-2004096285-A2 ANTI-INFECTIVE PHOSPHONATE CONJUGATES GILEAD SCIENCES, INC. (US) 2004-11-11 WO disclosed
WO-2004048397-A2 DETECTABLE LABELED NUCLEOSIDE ANALOGS AND METHODS OF USE THEREOF ROCHE DIAGNOSTICS GMBH (DE) 2004-06-10 WO disclosed
EP-0307361-A2 Process for the preparation of carbodiimides CIBA-GEIGY AG (CH) 1989-03-15 EP disclosed
EP-0127847-A1 7-Oxo-4-thia-1-azabicyclo(3.2.0)hept-2-ene derivatives HOECHST UK LIMITED (GB) 1984-12-12 EP disclosed