SCHEMBL4622161

SCHEMBL4622161

O=C(Nc1cc(C(F)(F)F)ccc1-c1cc(Nc2cccc3c2C[C@H](O)CC3)ncn1)C1CCCN1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 18/20 0.60
TRPM8 Q7Z2W7 1/20 0.40
OPRM1 P35372 1/20 0.39

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
SCHEMBL4597557 1.00 TRPV1 (0.60) TRPV1TRPM8OPRM1
SCHEMBL5932041 0.91 TRPV1 (0.56) TRPV1TRPM8
SCHEMBL5932039 0.91 TRPV1 (0.56) TRPV1TRPM8
SCHEMBL5141525 0.91 TRPV1 (0.56) TRPV1TRPM8
SCHEMBL5141528 0.91 TRPV1 (0.56) TRPV1TRPM8
SCHEMBL4610117 0.88 TRPV1 (0.60) TRPV1TRPM8OPRM1
SCHEMBL5931861 0.87 TRPV1 (0.55) TRPV1TRPM8OPRM1
SCHEMBL4621795 0.87 TRPV1 (0.71) TRPV1TRPM8OPRM1
SCHEMBL4620991 0.84 TRPV1 (0.70) TRPV1TRPM8OPRM1
SCHEMBL4620209 0.84 TRPV1 (0.62) TRPV1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1883632-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS Amgen Inc. (US) 2008-02-06 EP disclosed
WO-2006116563-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2006-11-02 WO disclosed
US-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol AMGEN INC. 2006-10-26 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 (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-20060241296-A1 Acute, inflammatory or neuropathic pain and inflammatory diseases such as asthma, rheumatoid arthritis, inflammatory bowel disorders, urinary incontinence, and psoriasis; e.g. 5-chloro-8-((6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yl)amino)-1,2,3,4-tetrahydronaphthalen-2-ol TRPV1, HRH2, TRPA1 TRPV1 1/4885TRPM8 66/4885OPRM1 324/4885

“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.