Aceclofenac

Aceclofenac

SCHEMBL5081852

O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl.O=C(O)Cc1ccccc1Nc1c(Cl)cccc1Cl

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS2

The experimentally established mechanism targets of Aceclofenac. 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
PTGS2 known ✓ P35354 7/20 0.78
TTR P02766 3/20 0.95
CYP2C9 P11712 2/20 0.95
USP2 O75604 1/20 0.95
LMNA P02545 1/20 0.95
TBXA2R P21731 1/20 0.95
MAPK1 P28482 1/20 0.95
KMT2A Q03164 1/20 0.95
CXCL8 P10145 3/20 0.78
PTGS1 P23219 2/20 0.78
AKR1B10 O60218 1/20 0.78
UGT1A9 O60656 1/20 0.78
TRPA1 O75762 1/20 0.78
ABCB11 O95342 1/20 0.78
MT-CO2 P00403 1/20 0.78
ALB P02768 1/20 0.78
UGT1A6 P19224 1/20 0.78
UGT1A1 P22309 1/20 0.78
CXCR1 P25024 1/20 0.78
ADRA1A P35348 1/20 0.78

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
Aceclofenac SCHEMBL29364020 0.97 TTR (1.00) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL25734 0.97 TTR (1.00) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL27918955 0.96 TTR (0.97) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL28443210 0.96 TTR (0.97) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL2905138 0.96 TTR (0.97) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL16697727 0.96 TTR (0.97) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL28873275 0.95 TTR (0.95) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL15268397 0.95 TTR (0.95) TTRCYP2C9USP2LMNATBXA2R
Aceclofenac SCHEMBL29775490 0.91 TTR (0.86) TTRCYP2C9USP2LMNATBXA2R
Diclofenac SCHEMBL29354260 0.88 PTGS2 (1.00) TTRCYP2C9USP2LMNATBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030004128-A1 Formulatios of adenosine a1 agonists BOUNTRA CHARANJIT (GB) 2003-01-02 US claimed
EP-1239879-A2 FORMULATIONS OF ADENOSINE A1 AGONISTS GLAXO GROUP LIMITED (GB) 2002-09-18 EP claimed
WO-2001045683-A2 FORMULATIONS OF ADENOSINE A1 AGONISTS GLAXO GROUP LIMITED (GB) 2001-06-28 WO claimed
US-7390817-B2 Combinations of a vanilloid antagonist and an NSAID for the treatment of pain GLAXO GROUP LIMITED (GB) 2008-06-24 US disclosed
US-20060093687-A1 Combinations of a vanilloid antagonist and an nsaid for the treatment of pain BOUNTRA CHARANJIT 2006-05-04 US disclosed
EP-1572237-A1 COMBINATIONS OF VANILLOID ANTAGONIST AND NSAID FOR THE TREATMENT OF PAIN GLAXO GROUP LIMITED (GB) 2005-09-14 EP disclosed
WO-2004056394-A1 COMBINATIONS OF A VANILLOID ANTAGONIST AND AN NSAID FOR THE TREATMENT OF PAIN GLAXO GROUP LIMITED (GB) 2004-07-08 WO disclosed
US-20030004128-A1 Formulatios of adenosine a1 agonists BOUNTRA CHARANJIT (GB) 2003-01-02 US disclosed
EP-1239879-A2 FORMULATIONS OF ADENOSINE A1 AGONISTS GLAXO GROUP LIMITED (GB) 2002-09-18 EP disclosed
WO-2001045683-A2 FORMULATIONS OF ADENOSINE A1 AGONISTS GLAXO GROUP LIMITED (GB) 2001-06-28 WO disclosed
WO-1997013519-A1 ESTERS OF CYCLOOXYGENASE INHIBITORS AND TERPENE DERIVATIVES AS PHARMACEUTICAL PRODUCTS RUSSINSKY LIMITED (IE) 1997-04-17 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-20060093687-A1 Combinations of a vanilloid antagonist and an nsaid for the treatment of pain TRPV1, TRPV2, TRPV3 PTGS2 129/4885TTR 1914/4885CYP2C9 809/4885
US-20030004128-A1 Formulatios of adenosine a1 agonists ADORA1, ADORA2A, ADORA2B PTGS2 25/4885TTR 2681/4885CYP2C9 470/4885

“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.