SCHEMBL6718754

SCHEMBL6718754

Cc1cc(-c2ccncc2-c2ccc(CS(=O)(=O)Cc3ccc(-c4cnccc4-c4ccc(C(F)(F)F)c(C)c4)cc3F)c(F)c2)ccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 7/20 0.41
CYP17A1 P05093 1/20 0.39
CYP11B1 P15538 7/20 0.39
CYP11B2 P19099 7/20 0.39
PTGS2 P35354 1/20 0.38
S1PR1 P21453 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
KIF11 P52732 1/20 0.36
GPBAR1 Q8TDU6 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
SCHEMBL6730242 0.91 S1PR1 (0.45) RPS6KA3CYP17A1CYP11B1CYP11B2PTGS2
SCHEMBL6725964 0.88 RPS6KA3 (0.45) RPS6KA3CYP11B1CYP11B2PTGS2
SCHEMBL6722648 0.88 RPS6KA3 (0.45) RPS6KA3CYP17A1PTGS2
SCHEMBL6725948 0.86 RPS6KA3 (0.46) RPS6KA3CYP17A1PTGS2
SCHEMBL6718677 0.84 PTGS2 (0.44) RPS6KA3CYP17A1PTGS2
SCHEMBL6728858 0.84 RPS6KA3 (0.43) RPS6KA3CYP17A1PTGS2
SCHEMBL6718921 0.84 RPS6KA3 (0.39) RPS6KA3CYP17A1PTGS2AAK1
SCHEMBL6723467 0.84 SLC22A12 (0.47) RPS6KA3KIF11GPBAR1
SCHEMBL6723317 0.84 RPS6KA3 (0.59) RPS6KA3PTGS2
SCHEMBL6729507 0.83 RPS6KA3 (0.51) RPS6KA3PTGS2

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 972/4885CYP17A1 800/4885CYP11B1 417/4885

“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.