SCHEMBL3686009

SCHEMBL3686009

CCCN(C[C@H](C)Sc1ccc(OCC(=O)O)c(C)c1)S(=O)(=O)c1sc2ccc(Cl)cc2c1C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 6/20 0.41
PTGDR2 Q9Y5Y4 8/20 0.38
SLC2A1 P11166 1/20 0.38
PPARA Q07869 3/20 0.37
PFKFB3 Q16875 3/20 0.37
PFKFB4 Q16877 3/20 0.37
CMA1 P23946 1/20 0.35
AKR1B1 P15121 1/20 0.35
PTGDR Q13258 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
SCHEMBL3683627 1.00 PPARD (0.41) PPARDPTGDR2SLC2A1PPARAPFKFB3
SCHEMBL3682368 1.00 PPARD (0.41) PPARDPTGDR2SLC2A1PPARAPFKFB3
SCHEMBL3688989 0.93 PFKFB3 (0.38) SLC2A1PFKFB3PFKFB4CMA1
SCHEMBL3684587 0.93 PFKFB3 (0.38) SLC2A1PFKFB3PFKFB4CMA1
SCHEMBL3683618 0.93 PPARD (0.40) PPARDPTGDR2PPARAAKR1B1PTGDR
SCHEMBL13508409 0.92 PPARD (0.40) PPARDPTGDR2SLC2A1PPARAPFKFB3
SCHEMBL13508288 0.92 PPARD (0.40) PPARDPTGDR2SLC2A1PPARAPFKFB3
SCHEMBL3679124 0.92 PPARD (0.40) PPARDPTGDR2SLC2A1PPARAPFKFB3
SCHEMBL3694979 0.91 PPARD (0.41) PPARDPPARACMA1
SCHEMBL3686938 0.89 PPARD (0.40) PPARDPPARA

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 7 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
EP-1597248-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-11-23 EP disclosed
WO-2004073606-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-09-02 WO 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 PPARD 1/4885PTGDR2 328/4885SLC2A1 66/4885

“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.