SCHEMBL29358069

SCHEMBL29358069

CC(C)NC[C@@H](O)COc1ccc(OCCOC(C)C)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 6/20 0.76
▸ ADRB1 P08588 5/20 0.76
▸ ADRB3 P13945 3/20 0.76
▸ PTGS1 P23219 1/20 0.68
▸ SLC6A2 P23975 1/20 0.68
▸ CYP2D6 P10635 3/20 0.66
▸ MAPT P10636 1/20 0.65
▸ MEN1 O00255 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ THRB P10828 1/20 0.64
▸ ALOX12 P18054 1/20 0.64
▸ NFKB1 P19838 1/20 0.64
▸ APEX1 P27695 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ NR3C1 P04150 1/20 0.63
▸ ADRA1A P35348 1/20 0.63
▸ CYP2J2 P51589 1/20 0.63
▸ PDE4D Q08499 1/20 0.63
▸ OPRK1 P41145 1/20 0.59

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
SCHEMBL13204416 0.87 ADRB1 (0.78) ADRB2ADRB1ADRB3CYP2D6MEN1
Bisoprolol SCHEMBL6510329 0.87 ADRB1 (1.00) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL233810 0.87 ADRB1 (1.00) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL20961 0.87 ADRB1 (1.00) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL20960 0.87 ADRB1 (1.00) ADRB2ADRB1ADRB3PTGS1SLC6A2
SCHEMBL11667770 0.87 ADRB2 (0.88) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL16821829 0.86 ADRB1 (0.98) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL3137111 0.86 ADRB2 (0.98) ADRB2ADRB1ADRB3PTGS1SLC6A2
Bisoprolol SCHEMBL4269272 0.86 ADRB1 (0.98) ADRB2ADRB1ADRB3PTGS1SLC6A2
SCHEMBL2594781 0.86 ADRB2 (0.65) ADRB2ADRB1ADRB3PTGS1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025245112-A1 NEUREGULIN-1/ANTI-HER3 ANTIBODY FUSION PROTEIN FOR USE IN THE TREATMENT OF HEART FAILURE SALUBRIS BIOTHERAPEUTICS, INC. (US) 2025-11-27 — — WO disclosed
EP-4630821-A2 BIOMARKER-BASED SYSTEMS AND METHODS OF DRUG IMPACT ASSESSMENT FOR USE IN PERSONALISED HEALTHCARE Randox Laboratories Ltd (GB) 2025-10-15 — — EP disclosed
US-20250312396-A1 Control of Cellular Redox Levels MCKENNA ELIZABETH (US) 2025-10-09 — — US disclosed
US-20250228917-A1 METHODS OF TREATING FIBROSIS AND ARRHYTHMIA WITH A NEUREGULIN-1 FUSION PROTEIN SALUBRIS BIOTHERAPEUTICS, INC. 2025-07-17 — — US disclosed
US-20250189526-A1 SIGNATURES AND DETERMINANTS FOR DIAGNOSING INFECTIONS AND METHODS OF USE THEREOF MEMED DIAGNOSTICS LTD. (IL) 2025-06-12 — — US disclosed
US-12268718-B2 Control of cellular redox levels LABYRINTH HOLDINGS LLC 2025-04-08 — — US disclosed
EP-4493580-A1 METHODS OF TREATING FIBROSIS AND ARRHYTHMIA WITH A NEUREGULIN-1 FUSION PROTEIN Salubris Biotherapeutics, Inc. (US) 2025-01-22 — — EP disclosed
US-12188934-B2 Signatures and determinants for diagnosing infections and methods of use thereof MEMED DIAGNOSTICS LTD. (IL) 2025-01-07 — — US disclosed
US-20240316085-A1 METHODS, AGENTS, AND DEVICES FOR LOCAL NEUROMODULATION OF AUTONOMIC NERVES Tulavi Therapeutics, Inc. 2024-09-26 — — US disclosed
US-12048676-B2 Agents for reversing toxic proteinopathies THE BROAD INSTITUTE, INC. (US) 2024-07-30 — — US disclosed
US-20220242815-A1 COMPOSITIONS AND METHODS RELATED TO DI-SUBSTITUTED BICYCLO[2.2.1] HEPTANAMINE-CONTAINING COMPOUNDS Instituto Carlos Slim de la Salud, A.C. (MX) 2022-08-04 — — US disclosed
WO-2022136254-A1 PHARMACEUTICAL PROFILER ARRAY FOR USE IN PERSONALISED HEALTHCARE RANDOX LABORATORIES LTD (GB) 2022-06-30 — — WO disclosed
WO-2022140677-A1 COMPOSITIONS AND METHODS RELATED TO DI-SUBSTITUTED BICYCLO[2.2.1] HEPTANAMINE-CONTAINING COMPOUNDS THE BROAD INSTITUTE, INC. (US) 2022-06-30 — — WO disclosed
WO-2022140654-A1 COMPOSITIONS AND METHODS RELATED TO BICYCLO[2.2.1] HEPTANAMINE-CONTAINING COMPOUNDS THE BROAD INSTITUTE, INC. (US) 2022-06-30 — — WO disclosed
US-20220127576-A1 COMPOSITIONS AND METHODS FOR STEM CELL THERAPY ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2022-04-28 — — US disclosed
EP-3986412-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES The Broad Institute, Inc. (US) 2022-04-27 — — EP disclosed
US-20220054433-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES THE BROAD INSTITUTE, INC. (US) 2022-02-24 — — US disclosed
US-11246879-B2 Methods, agents, and devices for local neuromodulation of autonomic nerves Tulai Therapeutics, Inc. (US) 2022-02-15 — — US disclosed
US-20220042994-A1 SIGNATURES AND DETERMINANTS FOR DIAGNOSING INFECTIONS AND METHODS OF USE THEREOF MEMED DIAGNOSTICS LTD. (IL) 2022-02-10 — — US disclosed
US-20220023233-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES THE BROAD INSTITUTE, INC. (US) 2022-01-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12048676-B2 Agents for reversing toxic proteinopathies MUC1, TMIGD3, TMED9 ADRB2 4151/4885ADRB1 3894/4885ADRB3 3963/4885
US-20220242815-A1 COMPOSITIONS AND METHODS RELATED TO DI-SUBSTITUTED BICYCLO[2.2.1] HEPTANAMINE-CONTAINING COMPOUNDS PHOSPHO1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, GRIN2C ADRB2 86/4885ADRB1 462/4885ADRB3 352/4885
US-20220054433-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES MUC1, TMIGD3, TMED9 ADRB2 4151/4885ADRB1 3894/4885ADRB3 3963/4885
US-20220023233-A1 AGENTS FOR REVERSING TOXIC PROTEINOPATHIES MUC1, TMIGD3, TMED9 ADRB2 4151/4885ADRB1 3894/4885ADRB3 3963/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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