SCHEMBL2172183

SCHEMBL2172183

CC(C(=O)O)[N+](=O)[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
SCHEMBL27896797 1.00
Hydrochloric Acid SCHEMBL11629378 0.97
SCHEMBL10355095 0.77
SCHEMBL28592099 0.74
SCHEMBL10499985 0.74
Ammonia Solution, Strong SCHEMBL11695860 0.74
SCHEMBL11867798 0.74
SCHEMBL9229615 0.74
SCHEMBL10512461 0.74
SCHEMBL28143851 0.74 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3506984-B1 COMPOUNDS AND COMPOSITIONS FOR USE AMPERSAND HOLDINGS LTD (GB) 2026-04-01 EP claimed
US-12453713-B2 Liquid formulation to treat a corneal tissue VISION ENGINEERING ITALY SRL (IT) 2025-10-28 US claimed
WO-2025151711-A1 NUCLEIC ACID VACCINES TARGETING METHANOGENS Arkea Bio Corp. (US) 2025-07-17 WO claimed
WO-2025151713-A1 PROTEIN AND PEPTIDE VACCINES TARGETING METHANOGENS Arkea Bio Corp. (US) 2025-07-17 WO claimed
US-20250222082-A1 PROTEIN AND PEPTIDE VACCINES TARGETING METHANOGENS ARKEA BIO CORP (US) 2025-07-10 US claimed
WO-2025128700-A1 CELL-BASED VACCINES Arkea Bio Corp. (US) 2025-06-19 WO claimed
EP-4554616-A1 COMPOSITIONS AND METHODS FOR REDUCING METHANE EMISSIONS IN RUMINANT POPULATIONS Arkea Bio Corp. (US) 2025-05-21 EP claimed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO claimed
WO-2025000802-A1 HEAT STABILIZER FOR PVC AND PREPARATION METHOD, MODIFIER, AND USE 江苏大学 2025-01-02 WO claimed
US-20240189408-A1 COMPOSITIONS AND METHODS FOR REDUCING METHANE EMISSIONS IN RUMINANT POPULATIONS Arkea Bio Corp. 2024-06-13 US claimed
US-20130130974-A1 NOVEL SYNTHETIC APPROACH TO beta-AMINOBUTYRYL SUBSTITUTED COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2013-05-23 US claimed
EP-2576563-A1 A NOVEL SYNTHETIC APPROACH TO ß-AMINOBUTYRYL SUBSTITUTED COMPOUNDS LEK Pharmaceuticals d.d. (SI) 2013-04-10 EP claimed
CN-103038236-A A novel synthetic approach to beta-aminobutyryl substituted compounds LEK PHARMACEUTICALS 2013-04-10 CN claimed
CN-102746210-A Synthesis method for key intermediate of silodosin JIANGSU YUTIAN BIOLOG MEDICAL TECHNOLOGY CO LTD 2012-10-24 CN claimed
WO-2011151443-A1 A NOVEL SYNTHETIC APPROACH TO ß-AMINOBUTYRYL SUBSTITUTED COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2011-12-08 WO claimed
EP-2392575-A1 A novel synthetic approach to ß-aminobutyryl substituted compounds LEK Pharmaceuticals d.d. (SI) 2011-12-07 EP claimed
US-7713401-B2 Methods for performing electrochemical nitration reactions BATTELLE ENERGY ALLIANCE, LLC (US) 2010-05-11 US claimed
US-20090038953-A1 METHODS FOR PERFORMING ELECTROCHEMICAL NITRATION REACTIONS ENERGY, UNITED STATES DEPARTMENT OF 2009-02-12 US claimed
WO-2009020798-A1 METHODS FOR PERFORMING ELECTROCHEMICAL NITRATION REACTIONS BATTELLE ENERGY ALLIANCE, LLC (US) 2009-02-12 WO claimed
EP-0170893-B1 MICROBIOCIDAL ANIONIC SEQUESTERANTS WITH POLYVALENT METAL CATIONS FOR PERMEABILITY CORRECTION PROCESS PHILLIPS PETROLEUM COMPANY (US) 1989-08-30 EP claimed