SCHEMBL4914213

SCHEMBL4914213

CC(C(=O)NCc1ccc(C(C)(C)C)nc1SC1CCCCC1)c1ccc(N(C)S(C)(=O)=O)c(F)c1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.76

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
SCHEMBL3465852 0.94 TRPV1 (0.76) TRPV1
SCHEMBL3465736 0.85 TRPV1 (0.75) TRPV1
SCHEMBL3465407 0.85 TRPV1 (0.74) TRPV1
SCHEMBL4914207 0.84 TRPV1 (0.87) TRPV1
SCHEMBL3465556 0.82 TRPV1 (0.75) TRPV1
SCHEMBL2162475 0.81 TRPV1 (0.70) TRPV1
SCHEMBL3465550 0.81 TRPV1 (0.89) TRPV1
SCHEMBL14797529 0.81 TRPV1 (0.81) TRPV1
SCHEMBL2529513 0.80 TRPV1 (1.00) TRPV1
SCHEMBL14797645 0.80 TRPV1 (0.81) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642623-B2 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2014-02-04 US claimed
EP-2146959-B1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS GRUENENTHAL GMBH (DE) 2013-06-19 EP claimed
US-20120302602-A1 Vanilloid Receptor Ligand Compounds, Pharmaceutical Compositions Containing Them, a Method of Producing Them and the Use Thereof to Treat Pain and Various Other Conditions GRUENENTHAL GMBH (DE) 2012-11-29 US claimed
US-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2008-10-30 US claimed
US-8642623-B2 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2014-02-04 US disclosed
EP-2146959-B1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS GRUENENTHAL GMBH (DE) 2013-06-19 EP disclosed
US-20120302602-A1 Vanilloid Receptor Ligand Compounds, Pharmaceutical Compositions Containing Them, a Method of Producing Them and the Use Thereof to Treat Pain and Various Other Conditions GRUENENTHAL GMBH (DE) 2012-11-29 US disclosed
US-8252816-B2 [1] N-(2-fluoro-4-(1-oxo-1-((2-(4-(N-phenylpropionamido)piperidin-1-yl)-6-(trifluoro-methyl)pyridin-3-yl)methylamino)propan-2-yl)phenyl)-N-(methylsulfonyl)propionamide; for treating acute pain, chronic pain, neuropathic pain and visceral pain; neurodegenerative disease, airway diseases GRUENENTHAL GMBH (DE) 2012-08-28 US disclosed
US-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2008-10-30 US 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-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions TRPV1, TRPV2, TRPV3 TRPV1 1/4885
US-20120302602-A1 Vanilloid Receptor Ligand Compounds, Pharmaceutical Compositions Containing Them, a Method of Producing Them and the Use Thereof to Treat Pain and Various Other Conditions TRPV1, TRPV2, TRPV3 TRPV1 1/4885

“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.