SCHEMBL3684828

SCHEMBL3684828

CCCN(CC(CC)Oc1cccc(CCC(=O)OC)c1)S(=O)(=O)c1sc2ccc(Cl)cc2c1C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PFKFB4 Q16877 7/20 0.41
PFKFB3 Q16875 6/20 0.41
CMA1 P23946 7/20 0.38
HTR6 P50406 3/20 0.37
SLC2A1 P11166 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL3687431 0.92 PFKFB3 (0.41) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL5173043 0.88 HTR6 (0.39) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL6269482 0.86 PFKFB4 (0.44) PFKFB4PFKFB3CMA1HTR6
SCHEMBL3689304 0.84 PFKFB3 (0.41) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL3689294 0.82 CMA1 (0.38) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL3690029 0.80 PPARG (0.40) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL3693825 0.80 HTR6 (0.41) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL3690490 0.79 CMA1 (0.36) CMA1
SCHEMBL3687554 0.78 SLC2A1 (0.39) PFKFB4PFKFB3CMA1HTR6SLC2A1
SCHEMBL3689885 0.78 SLC2A1 (0.40) PFKFB4PFKFB3CMA1HTR6SLC2A1

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 2 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-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 PFKFB4 469/4885PFKFB3 507/4885CMA1 4529/4885

“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.