SCHEMBL6482444

SCHEMBL6482444

O=S(=O)(Nc1ccc2c(OCc3coc(-c4ccc(Br)cc4)n3)cccc2c1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
HSPD1 P10809 1/20 0.40
HSPE1 P61604 1/20 0.40
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL6486402 0.92 CYSLTR2 (0.48) CYSLTR2CYSLTR1HSPD1HSPE1PPARA
SCHEMBL6487119 0.91 PPARG (0.44) CYSLTR2CYSLTR1HSPD1HSPE1PPARG
SCHEMBL6486062 0.91 CYSLTR2 (0.44) CYSLTR2CYSLTR1HSPD1HSPE1PPARG
SCHEMBL6477856 0.90 CYSLTR2 (0.42) CYSLTR2CYSLTR1HSPD1HSPE1IDO1
SCHEMBL6476526 0.83 CYSLTR2 (0.45) CYSLTR2CYSLTR1IDO1TDO2
SCHEMBL6476521 0.82 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL6488174 0.77 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL6476719 0.77 CYSLTR2 (0.49) CYSLTR2CYSLTR1HSPD1HSPE1IDO1
SCHEMBL6489349 0.77 CYSLTR2 (0.42) CYSLTR2CYSLTR1
SCHEMBL6483345 0.76 CYSLTR2 (0.48) CYSLTR2CYSLTR1IDO1TDO2

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-6933322-B2 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2005-08-23 US disclosed
US-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH 2003-11-20 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-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus INSR, GPR119, SLC5A1 CYSLTR2 4879/4885CYSLTR1 4791/4885HSPD1 2265/4885

“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.