SCHEMBL860766

SCHEMBL860766

COc1ccc2c(c1F)CSc1c(C(F)(F)F)nn(-c3ccc(S(N)(=O)=O)cc3)c1-2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 1.00
PTGS1 P23219 9/20 0.71

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
SCHEMBL30424119 1.00 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8934166 0.92 PTGS2 (0.84) PTGS2PTGS1
SCHEMBL8933916 0.91 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8933879 0.90 PTGS2 (0.82) PTGS2PTGS1
SCHEMBL8933882 0.87 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5071832 0.87 PTGS2 (0.77) PTGS2PTGS1
SCHEMBL13776402 0.86 PTGS2 (0.77) PTGS2PTGS1
SCHEMBL8933845 0.85 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL8933885 0.85 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL8933920 0.84 PTGS2 (0.72) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060093687-A1 Combinations of a vanilloid antagonist and an nsaid for the treatment of pain BOUNTRA CHARANJIT 2006-05-04 US claimed
EP-1572237-A1 COMBINATIONS OF VANILLOID ANTAGONIST AND NSAID FOR THE TREATMENT OF PAIN GLAXO GROUP LIMITED (GB) 2005-09-14 EP claimed
WO-2004056394-A1 COMBINATIONS OF A VANILLOID ANTAGONIST AND AN NSAID FOR THE TREATMENT OF PAIN GLAXO GROUP LIMITED (GB) 2004-07-08 WO claimed
EP-1239879-B1 FORMULATIONS OF ADENOSINE A1 AGONISTS AND COX2-INHIBITORS GLAXO GROUP LTD (GB) 2004-02-25 EP claimed
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-5547975-A ANTIARTHRIC AGENTS, ANALGESICS AND ANTIPYRETICS; INHIBITORS OF CYCLOOXYGENASE II; SIDE EFFECT REDUCTION G.D. SEARLE & CO. 1996-08-20 US claimed
WO-1996009304-A1 BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-28 WO claimed
US-20250339458-A1 USES OF MODIFIED RNA ENCODING RETINALDEHYDE DEHYDROGENASE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2025-11-06 US disclosed
US-20240148889-A1 STABILIZED TRIOXACARCIN ANTIBODY DRUG CONJUGATES AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-05-09 US disclosed
WO-2023096904-A2 C-16 MODIFIED TRIOXACARCINS, ANTIBODY DRUG CONJUGATES, AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-06-01 WO disclosed
WO-2021252708-A1 STABILIZED TRIOXACARCIN ANTIBODY DRUG CONJUGATES AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-12-16 WO disclosed
US-20210338709-A1 USES OF MODIFIED RNA ENCODING RETINALDEHYDE DEHYDROGENASE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-11-04 US 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
US-5565482-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS G.D. SEARLE & CO. (US) 1996-10-15 US disclosed
US-5547975-A ANTIARTHRIC AGENTS, ANALGESICS AND ANTIPYRETICS; INHIBITORS OF CYCLOOXYGENASE II; SIDE EFFECT REDUCTION G.D. SEARLE & CO. 1996-08-20 US disclosed
WO-1996009304-A1 BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-28 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 (3 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-20240148889-A1 STABILIZED TRIOXACARCIN ANTIBODY DRUG CONJUGATES AND USES THEREOF ABCB4, PCSK7, F12 PTGS2 4570/4885PTGS1 4271/4885
US-20060093687-A1 Combinations of a vanilloid antagonist and an nsaid for the treatment of pain TRPV1, TRPV2, TRPV3 PTGS2 129/4885PTGS1 59/4885
US-20030004128-A1 Formulatios of adenosine a1 agonists ADORA1, ADORA2A, ADORA2B PTGS2 25/4885PTGS1 20/4885

“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.