SCHEMBL3687141

SCHEMBL3687141

CCCN(CCCc1ccc(OCC(=O)O)cc1)S(=O)(=O)c1sc2ccc(Cl)cc2c1C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 2/20 0.44
PFKFB3 Q16875 5/20 0.41
PFKFB4 Q16877 5/20 0.41
CMA1 P23946 3/20 0.41
LPAR1 Q92633 2/20 0.40
LPAR2 Q9HBW0 1/20 0.40
HTR6 P50406 1/20 0.39
PTPN1 P18031 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CA9 Q16790 2/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39

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
SCHEMBL3689467 0.89 PTGDR2 (0.41) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3695828 0.88 CMA1 (0.43) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3682018 0.86 PFKFB3 (0.41) PFKFB3PFKFB4CMA1HTR6PTPN1
SCHEMBL3691319 0.86 PPARA (0.42) PFKFB3PFKFB4CMA1HTR6
SCHEMBL14338955 0.86 PTGDR2 (0.41) PFKFB3PFKFB4CMA1
SCHEMBL3679313 0.84 PFKFB3 (0.43) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3680701 0.83 PPARA (0.46) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3689893 0.82 PPARD (0.48) PFKFB3PFKFB4
SCHEMBL3756003 0.82 PPARA (0.41) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3683718 0.80 PPARD (0.51) PFKFB3PFKFB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 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-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG PTGIR 179/4885PFKFB3 507/4885PFKFB4 469/4885

“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.