SCHEMBL6725964

SCHEMBL6725964

Cc1cc(-c2ccncc2-c2ccc(CS(=O)(=O)Cc3ccc(-c4cnccc4-c4ccc(F)c(C)c4)cc3F)c(F)c2)ccc1F

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 10/20 0.45
PTGS2 P35354 3/20 0.42
PTGS1 P23219 1/20 0.40
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
SLC22A12 Q96S37 1/20 0.37
CYP11B2 P19099 3/20 0.36
CYP11B1 P15538 1/20 0.36
RPS6KA2 Q15349 1/20 0.36
RPS6KA1 Q15418 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 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
SCHEMBL6722648 0.93 RPS6KA3 (0.45) RPS6KA3PTGS2PTGS1SLC22A12RPS6KA2
SCHEMBL6725948 0.91 RPS6KA3 (0.46) RPS6KA3PTGS2SLC22A12RPS6KA2RPS6KA1
SCHEMBL6729769 0.90 RPS6KA3 (0.45) RPS6KA3PTGS2SLC22A12CYP11B2CYP11B1
SCHEMBL6718677 0.90 PTGS2 (0.44) RPS6KA3PTGS2PTGS1
SCHEMBL6728858 0.90 RPS6KA3 (0.43) RPS6KA3PTGS2PTGS1SLC22A12RPS6KA2
SCHEMBL6723317 0.89 RPS6KA3 (0.59) RPS6KA3PTGS2PTGS1SLC22A12RPS6KA2
SCHEMBL6729507 0.88 RPS6KA3 (0.51) RPS6KA3PTGS2SLC22A12RPS6KA2RPS6KA1
SCHEMBL6718754 0.88 RPS6KA3 (0.41) RPS6KA3PTGS2CYP11B2CYP11B1
SCHEMBL6730197 0.87 RPS6KA3 (0.43) RPS6KA3PTGS2PTGS1SLC22A12RPS6KA2
SCHEMBL6718429 0.87 PTGS2 (0.44) RPS6KA3PTGS2PTGS1SLC22A12RPS6KA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 RPS6KA3 972/4885PTGS2 5/4885PTGS1 4/4885

“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.