SCHEMBL13066063

SCHEMBL13066063

Cc1ccc(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3S(N)(=O)=O)cc2OCCC(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.47
SCN9A Q15858 7/20 0.38
F10 P00742 6/20 0.38
PRSS1 P07477 2/20 0.37
PLG P00747 1/20 0.37
PROC P04070 1/20 0.37
KLK1 P06870 1/20 0.37
ROCK2 O75116 1/20 0.36
ROCK1 Q13464 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL13065898 0.91 PTGES (0.48) PTGESSCN9AF10PRSS1PLG
SCHEMBL2805076 0.84 PTGES (0.52) PTGESCA1CA2CA9
SCHEMBL2802214 0.84 PTGES (0.47) PTGESF10PRSS1PLGPROC
SCHEMBL13066214 0.83 PTGES (0.47) PTGES
SCHEMBL2802883 0.80 PTGES (0.54) PTGES
SCHEMBL2803224 0.77 PTGES (0.67) PTGES
SCHEMBL13066213 0.77 PTGES (0.64) PTGESSCN9AROCK2ROCK1CA9
SCHEMBL2806473 0.76 PTGES (0.55) PTGESCA1CA2CA9
SCHEMBL13065899 0.76 PTGES (0.64) PTGESCA1CA2CA9
SCHEMBL2802125 0.74 PTGES (0.51) PTGESF10PRSS1CA1CA2

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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy PTGER1, SULT2A1, SULT1E1 PTGES 9/4885SCN9A 2169/4885F10 3420/4885

“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.