Penbutolol

Penbutolol

SCHEMBL49358

CC(C)(C)NCC(O)COc1ccccc1C1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 known ✓ P08588 6/20 0.62
ADRB2 known ✓ P07550 5/20 0.62
HTR1A P08908 5/20 1.00
ADRA2A P08913 3/20 1.00
SLC6A4 P31645 3/20 1.00
CYP2D6 P10635 2/20 1.00
ADRA1A P35348 2/20 1.00
SLC6A2 P23975 2/20 1.00
USP2 O75604 1/20 1.00
CYP1A2 P05177 1/20 1.00
CHRM1 P11229 1/20 1.00
CYP2C9 P11712 1/20 1.00
DRD1 P21728 1/20 1.00
TBXA2R P21731 1/20 1.00
PTGS1 P23219 1/20 1.00
OPRM1 P35372 1/20 1.00
DRD3 P35462 1/20 1.00
KCNH2 Q12809 1/20 1.00
MAPT P10636 1/20 0.60
ADRA2B P18089 1/20 0.57

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
Penbutolol SCHEMBL41408 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL6511962 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL31572112 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL30872868 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL1652319 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL29483932 1.00 HTR1A (1.00) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL7529895 0.99 HTR1A (0.98) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
Penbutolol SCHEMBL10570515 0.99 HTR1A (0.98) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
SCHEMBL8891641 0.99 HTR1A (0.98) HTR1AADRA2ASLC6A4CYP2D6ADRA1A
SCHEMBL9231829 0.95 HTR1A (0.90) HTR1AADRA2ASLC6A4CYP2D6ADRA1A

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 12943 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026087695-A1 TREATMENT FOR METABOLIC DISORDER SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
WO-2026087680-A1 TREATMENT FOR CARDIOVASCULAR DISEASE SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
EP-4727545-A2 COMBINATION TREATMENTS FOR DEPRESSION AND OTHER DISORDERS Neurawell Therapeutics (US) 2026-04-22 EP claimed
EP-4722714-A1 SIMULTANEOUS ANALYSIS OF FOOD-BORNE DOPING SUBSTANCES USING LIQUID CHROMATOGRAPHY-MASS SPECTROMETRY (VFD: VACCINE FOR FOODBORNE DOPING) Korea Institute of Science and Technology (KR) 2026-04-08 EP claimed
US-20260076953-A1 METHODS OF DIAGNOSING AND TREATING ADHD IN BIOMARKER POSITIVE SUBJECTS THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) 2026-03-19 US claimed
WO-2025262072-A2 NEURONAL DRUG SCREENING METHOD AND NEW APPLICATIONS FOR DILAZEP AND PENBUTOLOL MIĘDZYNARODOWY INSTYTUT BIOLOGII MOLEKULARNEJ I KOMÓRKOWEJ (PL) 2025-12-26 WO claimed
US-20250388639-A1 Therapeutic applications based on the inhibition of G Protein-Coupled Receptor 182 (GPR182) MAX PLANCK GESELLSCHAFT (DE) 2025-12-25 US claimed
US-20250367321-A1 COMPOSITIONS AND METHODS INVOLVING ADGRG6 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-12-04 US claimed
US-20250367152-A1 Inducing Proliferation of Cardiomyocytes and Therapeutic Uses Related Thereto UNIV EMORY (US) 2025-12-04 US claimed
EP-4630446-A1 ENGINEERED SWITCHES FOR IMMUNE CELL ACTIVITY AND METHODS OF USE THEREOF Dynamic Cell Therapies, Inc. (US) 2025-10-15 EP claimed
EP-0156318-A2 C-terminal amide cyclic renin inhibitors containing peptide isosteres MERCK & CO. INC. (US) 1985-10-02 EP claimed
EP-0156322-A2 Renin inhibitors containing peptide isosteres MERCK & CO. INC. (US) 1985-10-02 EP claimed
WO-1985004168-A1 SOFT beta-ADRENERGIC BLOCKING AGENTS BODOR NICHOLAS S 1985-09-26 WO claimed
EP-0129189-A2 Renin inhibitors containing a C-terminal amide cycle and compositions and combinations containing the same MERCK & CO. INC. (US) 1984-12-27 EP claimed
EP-0043548-B1 SALT OF FUROSEMIDE OR PIRETANIDE AS ACID COMPONENT AND PENBUTOLOL AS BASE COMPONENT AND PHARMACEUTICAL COMPOSITION CONTAINING BOTH OF THE SAID COMPONENTS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-25 EP claimed
EP-0105996-A1 Ophthalmic compositions for treating elevated intraocular pressure MERCK & CO. INC. (US) 1984-04-25 EP claimed
EP-0043548-A1 Salt of furosemide or piretanide as acid component and penbutolol as base component and pharmaceutical composition containing both of the said components HOECHST AKTIENGESELLSCHAFT (DE) 1982-01-13 EP claimed
US-4303637-A Medication indicated for ocular hypertension ALZA CORPORATION (US) 1981-12-01 US claimed
EP-0037622-A2 Drug delivery insert for controlled ocular therapy ALZA CORPORATION (US) 1981-10-14 EP claimed
US-4281654-A Drug delivery system for controlled ocular therapy ALZA CORPORATION (US) 1981-08-04 US claimed