SCHEMBL62389

SCHEMBL62389

O=[N+]([O-])OCC(O)CO

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
SCHEMBL9420277 1.00 ALDH1A1 (0.37)
Nitric Acid SCHEMBL15562819 0.96 CA5A (0.35)
Ethylene SCHEMBL11768572 0.96 ALDH1A1 (0.34)
Nitric Acid SCHEMBL7262025 0.96 CA5A (0.35)
Nitric Acid SCHEMBL44182 0.96 CA5A (0.35)
Acetic Acid SCHEMBL27494476 0.90 PTGS2 (0.35)
SCHEMBL2728056 0.87 ALDH1A1 (0.42)
Acetic Acid SCHEMBL11173531 0.87 PTGS2 (0.34)
Nitroglycerin SCHEMBL1746747 0.85 PTGS2 (0.36)
Nitric Acid SCHEMBL28312897 0.85 THRB (0.45)

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

Appears in 2081 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4740219-A1 METHOD OF PROVIDING A MEDICAL ASSISTANCE DEVICE FOR USE BY A NON-MEDICALLY TRAINED PERSON, AND DEVICE AND NETWORK THEREOF Aidency AS (NO) 2026-05-13 EP claimed
EP-4655403-A1 GENETIC MODIFICATION OF MICROBES FOR PRODUCTION OF NITROGEN-CONTAINING, NON-CARBON COMPOUNDS Fertis India Pvt Ltd (IN) 2025-12-03 EP claimed
WO-2025009980-A1 METHOD OF PROVIDING A MEDICAL ASSISTANCE DEVICE FOR USE BY A NON-MEDICALLY TRAINED PERSON, AND DEVICE AND NETWORK THEREOF AIDENCY AS (NO) 2025-01-09 WO claimed
CN-118436611-A Nitroglycerin sublingual tablet and detection method thereof 山东威智百科药业有限公司 2024-08-06 CN claimed
WO-2024121869-A1 GENETIC MODIFICATION OF MICROBES FOR PRODUCTION OF NITROGEN-CONTAINING, NON-CARBON COMPOUNDS FERTIS INDIA PVT. LTD. (IN) 2024-06-13 WO claimed
US-20230405191-A1 ANTIMICROBIAL CATHETERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-12-21 US claimed
CN-115810798-A Electrolyte solution, secondary battery, battery module, battery pack, and electric device 宁德时代新能源科技股份有限公司 2023-03-17 CN claimed
CN-113125596-B Method for determining related substances in nitroglycerin ointment by high performance liquid chromatography 马应龙药业集团股份有限公司(CN) 2023-01-13 CN claimed
EP-3419676-B1 ANTIMICROBIAL COMPOSITIONS AND USES THEREOF UNIV TEXAS (US) 2022-08-31 EP claimed
US-20220087963-A1 ANTIMICROBIAL COMPOSITIONS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-03-24 US claimed
EP-0357581-A1 Composition for the treatment of erectile dysfunction AMSU, Ltd. (GB) 1990-03-07 EP claimed
EP-0255515-B1 SMOKE-PRODUCING PROJECTILE NICO-PYROTECHNIK Hanns-Jürgen Diederichs GmbH & Co. KG (DE) 1989-07-19 EP claimed
EP-0304730-A1 Medicaments containing N-alkyl scopol amine salt and nitroglycerine, method for its preparation and its use G. Pohl-Boskamp GmbH &amp; Co. Chemisch-pharmazeutische Fabrik (DE) 1989-03-01 EP claimed
EP-0108248-B1 AQUEOUS NITROGLYCERINE SOLUTION FREE OF SOLUBILIZERS G. Pohl-Boskamp GmbH &amp; Co. Chemisch-pharmazeutische Fabrik (DE) 1988-12-28 EP claimed
EP-0157421-B1 SMOKE-PRODUCING PROJECTILE Pyrotechnische Fabrik F. Feistel GmbH + Co KG (DE) 1988-10-05 EP claimed
EP-0227252-A2 Medical device for pulsatile transdermal delivery of biologically active agents ALZA CORPORATION (US) 1987-07-01 EP claimed
US-4664729-A ABILITY TO WITHSTAND UNDERWATER WAVE COMPRESSION INDEPENDENT EXPLOSIVES CO. OF PENNA. (US) 1987-05-12 US claimed
EP-0116944-B1 GLYCERINE MONONITRATE FOR THE TREATMENT OF ANGINA PECTORIS Heinrich Mack Nachf. (DE) 1986-08-20 EP claimed
US-4560425-A LiClO4 Containing propellant compositions HI-SHEAR CORPORATION (US) 1985-12-24 US claimed
EP-0116944-A1 Glycerine mononitrate for the treatment of angina pectoris Heinrich Mack Nachf. (DE) 1984-08-29 EP claimed