SCHEMBL6484833

SCHEMBL6484833

O=S(=O)(Nc1ccc2c(OCc3csc(-c4ccccc4Cl)n3)cccc2c1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.46
CYSLTR1 Q9Y271 1/20 0.46
PPARG P37231 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CTPS1 P17812 1/20 0.38
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
EPHA2 P29317 1/20 0.36
KDR P35968 1/20 0.36
EPHB4 P54760 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
SCHEMBL6476503 0.88 CYSLTR2 (0.48) CYSLTR2CYSLTR1ALDH1A1
SCHEMBL6487034 0.88 SCN9A (0.45) CYSLTR2CYSLTR1SCN9AEGFRERBB2
SCHEMBL6477943 0.86 CYSLTR2 (0.41) CYSLTR2CYSLTR1CTPS1SCN9AEGFR
SCHEMBL6485372 0.86 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL6485303 0.86 CYSLTR2 (0.45) CYSLTR2CYSLTR1EGFRERBB2EPHA2
SCHEMBL6477804 0.85 CYSLTR2 (0.42) CYSLTR2CYSLTR1CTPS1SCN9AEGFR
SCHEMBL6526673 0.84 EGFR (0.46) CYSLTR2CYSLTR1PPARGSCN5ASCN9A
SCHEMBL6475810 0.83 CYSLTR2 (0.42) CYSLTR2CYSLTR1PPARGEGFRERBB2
SCHEMBL6485920 0.83 SHMT2 (0.44) CYSLTR2CYSLTR1PPARGALDH1A1EGFR
SCHEMBL6486897 0.83 MAPT (0.44) CYSLTR2CYSLTR1PPARGALDH1A1TDP1

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 4791/4885PPARG 696/4885

“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.