Rocuronium

Rocuronium

SCHEMBL41320

C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](O)[C@@H](N6CCOCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(C)=O)CCCC1.[Br-]

nearest known ligand 0.99

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRNA1CHRNB1CHRNDCHRNECHRNG

The experimentally established mechanism targets of Rocuronium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.99
▸ AGTR1 P30556 1/20 0.99
▸ SLC22A2 O15244 1/20 0.58
▸ SLC47A2 Q86VL8 1/20 0.58
▸ SLC47A1 Q96FL8 1/20 0.58
▸ HRH3 Q9Y5N1 1/20 0.57
▸ LMNA P02545 1/20 0.52
▸ RAD52 P43351 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MTOR P42345 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Rocuronium SCHEMBL1036090 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL1036092 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL6067603 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL3835255 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL3986752 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL3986751 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL6067600 1.00 KCNH2 (0.99) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Bromide SCHEMBL10589679 0.99 KCNH2 (0.97) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Bromide SCHEMBL10589682 0.99 KCNH2 (0.97) KCNH2AGTR1SLC22A2SLC47A2SLC47A1
Rocuronium SCHEMBL3823993 0.99 KCNH2 (1.00) KCNH2AGTR1SLC22A2SLC47A2SLC47A1

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 2249 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076560-B1 SURFACE MODIFYING COATING FOR MEDICAL DEVICES HOSPIRA INC (US) 2026-04-01 — — EP claimed
US-20260076872-A1 POLYMER VIALS WITH SUBSTANTIALLY FLAT BOTTOMS AND INJECTION STRETCH BLOW MOLDING METHODS FOR MAKING THE SAME SIO2 MEDICAL PRODUCTS LLC (US) 2026-03-19 — — US claimed
EP-4687914-A1 A ROOM-TEMPERATURE STABLE, UNBUFFERED FORMULATION OF ROCURONIUM BROMIDE INJECTION FOR INTRAVENOUS ADMINISTRATION AND A METHOD THEREOF Maiva Pharma Private Limited (IN) 2026-02-11 — — EP claimed
US-20250339621-A1 ROCURONIUM IN PREFILLED SYRINGES BRAUN MELSUNGEN AG (DE) 2025-11-06 — — US claimed
EP-4618945-A1 COMPOSITION COMPRISING ROCURONIUM B. Braun Melsungen AG (DE) 2025-09-24 — — EP claimed
US-20250242092-A1 SiOx BARRIER FOR PHARMACEUTICAL PACKAGE AND COATING PROCESS SIO2 MEDICAL PRODUCTS INC (US) 2025-07-31 — — US claimed
CN-120142194-A Optical fiber sensor for detecting drug concentration and drug concentration detection system 西安交通大学医学院第一附属医院 2025-06-13 — — CN claimed
CN-118319854-B Prefilled sodium gluconate and sodium chloride injection 天津睿创康泰生物技术有限公司 2025-05-16 — — CN claimed
CN-119909011-A Preparation method of rocuronium bromide injection 华中药业股份有限公司 2025-05-02 — — CN claimed
CN-119816504-A Imidazolium salt macrocyclic compound, and preparation method and application thereof 复旦大学 2025-04-11 — — CN claimed
US-6949527-B2 6-Mercapto-cyclodextrin derivatives: reversal agents for drug-induced neuromuscular block AKZO NOBEL N.V. (NL) 2005-09-27 — — US claimed
WO-2005068487-A2 PROCESSES FOR THE PREPARATION OF ROCURONIUM BROMIDE AND INTERMEDIATES THEREOF CHEMAGIS LTD. (IL) 2005-07-28 — — WO claimed
US-20050159398-A1 Processes for the preparation of rocuronium bromide and intermediates thereof WAVELENGTH ENTERPRISES LTD (IL) 2005-07-21 — — US claimed
US-20050153932-A1 Controlled muscle relaxation N.V. ORGANON (NL) 2005-07-14 — — US claimed
US-20050137141-A1 Prodrug composition HILFINGER JOHN (US) 2005-06-23 — — US claimed
CN-1188428-C 6-mercapto-cyclodextrin derivs.: resersal agent for drug-induced neuromuscular block AKZO NOBEL NV (NL) 2005-02-09 — — CN claimed
US-20040029833-A1 6-Mercapto-cyclodextrin derivatives: reversal agents for drug-induced neuromuscular block MERCK SHARP & DOHME B.V. (NL) 2004-02-12 — — US claimed
CN-1370073-A Use of chemical chelators as reversal agents for drug-induced neuromuscular block AKZO NOBEL NV (NL) 2002-09-18 — — CN claimed
WO-2000044334-A2 NOVEL INJECTABLE MUSCLE RELAXANT FORMULATIONS PATEL DINESH SHANTILAL (IN) 2000-08-03 — — WO claimed
US-5767112-A ACIDIC MIXTURE FOR INJECTION COMPRISING NEUROMUSCULAR BLOCKING AGENT AND ZWITTERION HAVING ISOELECTRIC POINT GREATER THAN 7; SHELF LIFE, ANESTHETIC POLI INDUSTRIA CHIMICA, S.P.A. (IT) 1998-06-16 — — US claimed
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