Montelukast

Montelukast

SCHEMBL130083

CC(C)(O)c1ccccc1CCC(SCC1(CC(=O)O)CC1)c1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYSLTR1

The experimentally established mechanism targets of Montelukast. 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
CYSLTR1 known ✓ Q9Y271 15/20 1.00
CYSLTR2 Q9NS75 14/20 1.00
CYP2C8 P10632 2/20 1.00
MEN1 O00255 1/20 1.00
RECQL P46063 1/20 1.00
BLM P54132 1/20 1.00
KMT2A Q03164 1/20 1.00
ABCB11 O95342 1/20 1.00
EGFR P00533 1/20 1.00
ESR1 P03372 1/20 1.00
NR3C1 P04150 1/20 1.00
FYN P06241 1/20 1.00
PGR P06401 1/20 1.00
ADRB2 P07550 1/20 1.00
ADRB1 P08588 1/20 1.00
ADRA2A P08913 1/20 1.00
ADORA3 P0DMS8 1/20 1.00
CHRM1 P11229 1/20 1.00
ADRB3 P13945 1/20 1.00
ADRA2B P18089 1/20 1.00

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
Montelukast SCHEMBL29369663 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL4487 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL31060351 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL15656168 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL1149660 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL4486 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL12702747 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL22207045 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL21635556 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
Montelukast SCHEMBL29674830 1.00 CYSLTR1 (1.00) CYSLTR1CYSLTR2CYP2C8MEN1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150087690-A1 G PROTEIN-COUPLED PURINERGIC RECEPTOR Gpr17 MEDIATES OREXIGENIC EFFECTS OF FOXO1 IN AGRP NEURONS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-03-26 US claimed
EP-1933842-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS Amira Pharmaceuticals, Inc. (US) 2008-06-25 EP claimed
WO-2007047207-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-04-26 WO claimed
CN-117024340-A Synthesis method of montelukast sodium 迪嘉药业集团股份有限公司 2023-11-10 CN disclosed
WO-2020245358-A1 MONTELUKAST SALTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME GENETIC S.P.A. (IT) 2020-12-10 WO disclosed
US-10758478-B2 Active agent loaded uniform, rigid, spherical, nanoporous calcium phosphate particles and methods of making and using the same LABORATORY SKIN CARE, INC. (US) 2020-09-01 US disclosed
EP-3505172-A1 A PHARMACEUTICAL COMPOSITION COMPRISING MONTELUKAST AND LEVOCETIRIZINE Abdi Ibrahim Ilac Sanayi ve Ticaret A.S. (TR) 2019-07-03 EP disclosed
US-9717684-B2 Stable montelukast solution R.P. SCHERER TECHNOLOGIES, LLC (US) 2017-08-01 US disclosed
US-9616056-B2 Inhibition of leukotriene synthesis and activity in the treatment of sonic hedgehog-associated medulloblastoma INSTITUTE FOR CANCER RESEARCH (US) 2017-04-11 US disclosed
EP-3134076-A1 A STABLE MONTELUKAST SOLUTION R.P. Scherer Technologies, LLC (US) 2017-03-01 EP disclosed
US-9359376-B2 Substituted methylformyl reagents and method of using same to modify physicochemical and/or pharmacokinetic properties of compounds SPHAERA PHARMA PTE. LTD (SG) 2016-06-07 US disclosed
WO-2005065649-A1 INHALANT FORMULATION CONTAINING SULFOALKYL ETHER Ϝ-CYCLODEXTRIN AND CORTICOSTEROID CYDEX, INC. (US) 2005-07-21 WO disclosed
EP-1357928-A4 A NOVEL PHARMACEUTICAL COMPOUND AND METHODS OF MAKING AND USING SAME NEW RIVER PHARMACEUTICALS INC (US) 2004-12-29 EP disclosed
EP-1490090-A2 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS New River Pharmaceuticals Inc. (US) 2004-12-29 EP disclosed
WO-2004043966-A1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL PRODESFARMA S.A. (ES) 2004-05-27 WO disclosed
WO-2003066598-A9 NOVEL ANHYDROUS AMORPHOUS FORMS OF MONTELUKAST SODIUM SALT REDDYS LAB LTD DR (IN) 2003-12-04 WO disclosed
EP-1357928-A2 A NOVEL PHARMACEUTICAL COMPOUND AND METHODS OF MAKING AND USING SAME New River Pharmaceuticals Inc. (US) 2003-11-05 EP disclosed
WO-2003079972-A2 ACTIVE AGENT DELIVERY SYSTEMS AND METHODS FOR PROTECTING AND ADMINISTERING ACTIVE AGENTS NEW RIVER PARMACEUTICALS INC. (US) 2003-10-02 WO disclosed
WO-2003066598-A1 NOVEL ANHYDROUS AMORPHOUS FORMS OF MONTELUKAST SODIUM SALT DR. REDDY'S LABORATORIES LTD. (IN) 2003-08-14 WO disclosed
WO-2003020200-A2 A NOVEL PHARMACEUTICAL COMPOUND AND METHODS OF MAKING AND USING SAME NEW RIVER PHARMACEUTICALS INC. (US) 2003-03-13 WO 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 (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-10758478-B2 Active agent loaded uniform, rigid, spherical, nanoporous calcium phosphate particles and methods of making and using the same CHERP, ORAI1, CA2 CYSLTR1 2990/4885CYSLTR2 2852/4885CYP2C8 4474/4885

“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.