Etoricoxib

Etoricoxib

SCHEMBL14126237

Cc1ccc(-c2ncc(Cl)cc2-c2ccc(S(C)(=O)=O)cc2)cn1.Cc1ccc(-c2ncc(Cl)cc2-c2ccc(S(C)(=O)=O)cc2)cn1.O

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS2

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

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 20/20 0.97
PTGS1 P23219 10/20 0.97
ABCC4 O15439 1/20 0.97
ABCB11 O95342 1/20 0.97
PDE4D Q08499 1/20 0.97
MAPK14 Q16539 1/20 0.97

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
Etoricoxib SCHEMBL28893910 1.00 PTGS2 (0.97) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL29366203 0.99 PTGS2 (1.00) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL29402456 0.99 PTGS2 (1.00) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL14163961 0.99 PTGS2 (1.00) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL4680 0.99 PTGS2 (1.00) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL30988052 0.99 PTGS2 (1.00) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL321747 0.97 PTGS2 (0.97) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL183950 0.97 PTGS2 (0.97) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL322344 0.97 PTGS2 (0.97) PTGS2PTGS1ABCC4ABCB11PDE4D
Etoricoxib SCHEMBL28319282 0.96 PTGS2 (0.95) PTGS2PTGS1ABCC4ABCB11PDE4D

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655231-B2 Etoricoxib solvates and preparation method thereof TIANJIN UNIVERSITY (CN) 2023-05-23 US disclosed
US-20210300892-A1 ETORICOXIB SOLVATES AND PREPARATION METHOD THEREOF TIANJIN UNIVERSITY 2021-09-30 US disclosed
CN-111410629-A Etoricoxib solvate and preparation method thereof 天津大学 2020-07-14 CN disclosed
EP-2714676-B1 A PROCESS FOR THE PREPARATION OF POLYMORPHIC FORM I OF ETORICOXIB FARMA GRS D O O (SI) 2019-04-24 EP disclosed
EP-2888231-B1 PROCESS FOR PREPARATION OF CRYSTALLINE ETORICOXIB GLENMARK PHARMACEUTICALS LTD (IN) 2019-01-09 EP disclosed
EP-2888231-A2 PROCESS FOR PREPARATION OF CRYSTALLINE ETORICOXIB Glenmark Pharmaceuticals Limited (IN) 2015-07-01 EP disclosed
WO-2014041558-A2 PROCESS FOR PREPARATION OF CRYSTALLINE ETORICOXIB GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-03-20 WO disclosed
WO-2012163839-A1 A PROCESS FOR THE PREPARATION OF POLYMORPHIC FORM I OF ETORICOXIB FARMA GRS, D.O.O. (SI) 2012-12-06 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 (2 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-20210300892-A1 ETORICOXIB SOLVATES AND PREPARATION METHOD THEREOF ETV1, PTGES3, EIF4E PTGS2 15/4885PTGS1 8/4885ABCC4 4072/4885
US-11655231-B2 Etoricoxib solvates and preparation method thereof ETV1, PTGES3, EIF4E PTGS2 15/4885PTGS1 8/4885ABCC4 4072/4885

“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.