SCHEMBL2485079

SCHEMBL2485079

O=[N+]([O-])N1CCNCC1

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
Methane SCHEMBL27938574 0.97 ADRB1 (0.41)
Hydrochloric Acid SCHEMBL9067551 0.97 ADRB1 (0.41)
SCHEMBL1405613 0.83
Methane SCHEMBL28356450 0.81
SCHEMBL251934 0.81 MEN1 (0.33)
SCHEMBL13938850 0.81
SCHEMBL4366628 0.75
SCHEMBL3795933 0.75
SCHEMBL5903610 0.75
SCHEMBL2347952 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108484523-A Benzo oxa- oxadiazole derivatives and its preparation method and application 江苏省农用激素工程技术研究中心有限公司 2018-09-04 CN claimed
CN-104684588-B Liquid activation agents with surfactant 宝洁公司 2018-02-16 CN claimed
US-12202826-B2 N-pyridinyl acetamide derivatives as inhibitors of the Wnt signaling pathway REDX PHARMA PLC (GB) 2025-01-21 US disclosed
US-11958809-B2 Salt of omecamtiv mecarbil and process for preparing salt CYTOKINETICS, INC. (US) 2024-04-16 US disclosed
US-20240101517-A1 SALT OF OMECAMTIV MECARBIL AND PROCESS FOR PREPARING SALT AMGEN INC. 2024-03-28 US disclosed
EP-4305018-A2 SYNTHESIS OF OMECAMTIV MECARBIL Amgen Inc. (US) 2024-01-17 EP disclosed
CN-117157274-A Synthesis of olmesartan Mo Kabi mol 安进股份有限公司 2023-12-01 CN disclosed
US-20230365549-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY REDX PHARMA PLC (GB) 2023-11-16 US disclosed
US-11814348-B2 Oxidizing liquid media for chemical transformations UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-11-14 US disclosed
US-11702380-B2 Synthesis of omecamtiv mecarbil AMGEN INC. (US) 2023-07-18 US disclosed
US-11643408-B2 N-pyridinyl acetamide derivatives as inhibitors of the WNT signaling pathway REDX PHARMA PLC (GB) 2023-05-09 US disclosed
WO-2009012455-A1 PROPPANTS WITH CARBIDE AND/OR NITRIDE PHASES OXANE MATERIALS, INC. (US) 2009-01-22 WO disclosed
WO-2008018966-A2 A COMPOSITION AND METHOD FOR MAKING A PROPPANT OXANE MATERIALS, INC. (US) 2008-02-14 WO disclosed
EP-1851210-A2 NITRO-SUBSTITUTED PHENYL-PIPERAZINE COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-11-07 EP disclosed
EP-1676842-A1 Nitro-substituted phenyl-piperazine compounds, their preparation and use in medicaments LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2006-07-05 EP disclosed
WO-2004078717-A1 ACYLATED PIPERAZINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR AGONISTS MERCK & CO., INC. (US) 2004-09-16 WO disclosed
US-5561140-A IMMUNOSUPPRESSANTS; SIDE EFFECT REDUCTION ABBOTT LABORATORIES (US) 1996-10-01 US disclosed
US-5530119-A IMMUNOSUPPRESSANTS ABBOTT LABORATORIES (US) 1996-06-25 US disclosed
EP-0690713-A1 SUBSTITUTED ALICYCLIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1996-01-10 EP disclosed
WO-1994021254-A1 SUBSTITUTED ALICYCLIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1994-09-29 WO disclosed