SCHEMBL4506325

SCHEMBL4506325

Cc1cc(C)c(N(c2c(C)cc(C)cc2C)S(=O)(=O)c2cc(S(N)(=O)=O)cc3ccc(O)cc23)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.56
RAPGEF4 Q8WZA2 1/20 0.37
CA2 P00918 6/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
CA1 P00915 1/20 0.34
GAA P10253 2/20 0.34
ALDH1A1 P00352 1/20 0.34
PKM P14618 1/20 0.34
GLO1 Q04760 2/20 0.33
CYTH2 Q99418 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
NSD2 O96028 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL4500899 0.92 PTGES (0.46) PTGESCA2CA12CA9CA1
SCHEMBL4519118 0.87 PTGES (0.50) PTGESRAPGEF4CA2CA12CA9
SCHEMBL4491363 0.84 ESR1 (0.43) PTGESCA2CA12CA9CA1
SCHEMBL4516373 0.84 CYP1A2 (0.41) PTGESCA2CA12CA9CA1
SCHEMBL4505853 0.83 PTGES (0.46) PTGESCA2CA12CA9CA1
SCHEMBL4497044 0.82 PTGES (0.45) PTGESCA2CA1ALDH1A1PKM
SCHEMBL4511817 0.81 PTGES (0.43) PTGESCA2CA12CA9CA1
SCHEMBL4511956 0.81 PTGES (0.43) PTGESCA2CA12CA9CA1
SCHEMBL4494785 0.80 ESR1 (0.49) PTGESCA2CA12CA9CA1
SCHEMBL4511441 0.79 PTGES (0.40) PTGESCA2CA12CA9CA1

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-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation BIOLIPOX AB (SE) 2009-09-17 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-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation AREG, PRSS12, CXCL8 PTGES 41/4885RAPGEF4 3443/4885CA2 2959/4885

“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.