SCHEMBL13265255

SCHEMBL13265255

BN[C@H](C)c1cc(F)c(NS(C)(=O)=O)c(C=C)c1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.34
ADRA2C P18825 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31

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
SCHEMBL2953335 0.84 ADRA2C (0.35) TRPV1ADRA2CADRA1AADRA1B
SCHEMBL2957662 0.84 ADRA2C (0.35) TRPV1ADRA2CADRA1AADRA1B
SCHEMBL2948334 0.78 TRPV1 (0.41) TRPV1
SCHEMBL13238826 0.78 TRPV1 (0.41) TRPV1
SCHEMBL14879084 0.72 ADRA2C (0.33) ADRA2CADRA1AADRA1B
SCHEMBL13063321 0.72 TRPV1 (0.36) TRPV1ADRA2CADRA1AADRA1B
SCHEMBL13538972 0.72 ALDH1A1 (0.39) TRPV1ADRA2CADRA1AADRA1B
SCHEMBL2955724 0.72 TRPV1 (0.52) TRPV1
SCHEMBL2959320 0.72 TRPV1 (0.52) TRPV1
SCHEMBL2959321 0.72 TRPV1 (0.52) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763657-B2 Compounds, isomer thereof, or pharmaceutically acceptable salts thereof as vanilloid receptor antagonist; and pharmaceutical compositions containing the same AMOREPACIFIC CORPORATION (KR) 2010-07-27 US disclosed
US-20090105258-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST; AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2009-04-23 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-20090105258-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST; AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME TRPV1, TRPA1, VIPR1 TRPV1 1/4885ADRA2C 472/4885ADRA1A 244/4885

“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.