(S)-Metoprolol

(S)-Metoprolol

SCHEMBL123231

COCCc1ccc(OC[C@@H](O)CNC(C)C)cc1.O=C(O)C=CC(=O)O

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1

The experimentally established mechanism targets of (S)-Metoprolol. 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 3/20 0.82
ADRB2 P07550 3/20 0.82
ADRA1A P35348 2/20 0.82
NR3C1 P04150 1/20 0.82
CYP2D6 P10635 1/20 0.82
CYP2J2 P51589 1/20 0.82
PDE4D Q08499 1/20 0.82
TDP1 Q9NUW8 3/20 0.81
PMP22 Q01453 2/20 0.81
NPY1R P25929 1/20 0.81
NPY2R P49146 1/20 0.81
NPSR1 Q6W5P4 1/20 0.81
LMNA P02545 3/20 0.67
NFKB1 P19838 2/20 0.67
MEN1 O00255 1/20 0.67
THRB P10828 1/20 0.67
ALOX12 P18054 1/20 0.67
APEX1 P27695 1/20 0.67
MAPK1 P28482 1/20 0.67
KMT2A Q03164 1/20 0.67

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
Metoprolol SCHEMBL123230 1.00 ADRB2 (0.82) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL10634188 0.96 ADRB2 (0.75) ADRB2ADRB1ADRA1ANR3C1CYP2D6
(S)-Metoprolol SCHEMBL3123844 0.92 ADRB2 (0.88) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL3123840 0.92 ADRB2 (0.88) ADRB2ADRB1ADRA1ANR3C1CYP2D6
(S)-Metoprolol SCHEMBL9636561 0.92 TDP1 (0.72) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL7274530 0.92 TDP1 (0.72) ADRB2ADRB1ADRA1ANR3C1CYP2D6
(S)-Metoprolol SCHEMBL7274540 0.92 TDP1 (0.72) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL9636584 0.92 TDP1 (0.72) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL1561123 0.91 ADRB1 (1.00) ADRB2ADRB1ADRA1ANR3C1CYP2D6
Metoprolol SCHEMBL4093 0.91 ADRB1 (1.00) ADRB2ADRB1ADRA1ANR3C1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106309399-B A kind of micro-pill type sustained release tablets and preparation method thereof 深圳翰宇药业股份有限公司 2019-07-26 CN claimed
US-20180280405-A1 PHARMACEUTICAL FORMULATIONS OF POTASSIUM ATP CHANNEL OPENERS AND USES THEREOF SOLENO THERAPEUTICS, INC. 2018-10-04 US claimed
CN-103211792-B Metoprolol fumarate film-controlled slow-release micro pill capsule 北京天衡药物研究院有限公司 2018-02-02 CN claimed
WO-2017134200-A1 A NOVEL PHARMACEUTICAL COMPOSITION OF VORAPAXAR AND METOPROLOL SANOVEL ILAC SANAYI VE TICARET A.S. (TR) 2017-08-10 WO claimed
WO-2017134199-A1 A PHARMACEUTICAL COMPOSITION OF VORAPAXAR AND METOPROLOL SANOVEL ILAC SANAYI VE TICARET A.S. (TR) 2017-08-10 WO claimed
CN-105561323-A Sustained-release pharmaceutical preparation for treating heart disease and preparation method thereof BEIJING HOSPITAL OF MINI OF HEALTH 2016-05-11 CN claimed
CN-105560186-A Slow-release medicinal preparation for treating heart diseases BEIJING HOSPITAL OF MINI OF HEALTH 2016-05-11 CN claimed
CN-102784143-B A kind of single layer osmotic pump regulated-release preparations containing metoprolol and felodipine Institute of Toxicology and Drugs, Chinese Academy of Military Medical Sciences (CN) 2015-09-30 CN claimed
CN-104523642-A Metoprolol sustained-release tablet and preparation method thereof TIAN WU 2015-04-22 CN claimed
CN-102018658-B Controlled release preparation and preparation method thereof ZHONG SHUGUANG 2014-03-12 CN claimed
WO-2001074394-A1 NEW COMBINATION OF A BETABLOCKER AND A CHOLESTEROL-LOWERING AGENT ASTRAZENECA AB (SE) 2001-10-11 WO claimed
WO-2000072827-A2 POROUS DRUG MATRICES AND METHODS OF MANUFACTURE THEREOF ACUSPHERE, INC. (US) 2000-12-07 WO claimed
EP-0412053-B1 Supercritical fluid and near critical gas extraction of organic solvents from formed articles CIBA GEIGY AG (CH) 1995-05-10 EP claimed
US-5287632-A Supercritical fluid and near critical gas extraction of organic solvents from formed articles CIBA-GEIGY CORPORATION (US) 1994-02-22 US claimed
EP-0412053-A2 Supercritical fluid and near critical gas extraction of organic solvents from formed articles CIBA-GEIGY AG (CH) 1991-02-06 EP claimed
US-4892739-A Osmotic continuous dispensing oral delivery system containing a pharmaceutically acceptable active agent having a improved core membrane adhesion properties CIBA-GEIGY CORPORATION (US) 1990-01-09 US claimed
EP-0148811-B1 PHARMACEUTICAL COMPOSITION LEJUS MEDICAL AKTIEBOLAG (SE) 1989-09-06 EP claimed
US-4780318-A DIFFERENT SOLUBILITIES AT DIFFERENT PHS LEJUS MEDICAL AKTIEBOLAG (SE) 1988-10-25 US claimed
EP-0148811-A1 Pharmaceutical composition LEJUS MEDICAL AKTIEBOLAG (SE) 1985-07-17 EP claimed
US-4281654-A Drug delivery system for controlled ocular therapy ALZA CORPORATION (US) 1981-08-04 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20180280405-A1 PHARMACEUTICAL FORMULATIONS OF POTASSIUM ATP CHANNEL OPENERS AND USES THEREOF KCNJ1, KCNJ11, KCNJ8 ADRB1 446/4885ADRB2 664/4885ADRA1A 401/4885

“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.