SCHEMBL3689331

SCHEMBL3689331

CCCN(CCOc1ccc2c(ccn2C(C)(C)C(=O)O)c1)S(=O)(=O)c1sc2ccc(F)cc2c1C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PER2 O15055 4/20 0.36
CRY1 Q16526 4/20 0.36
CRY2 Q49AN0 4/20 0.36
CMA1 P23946 6/20 0.34
PPARG P37231 4/20 0.34
PPM1A P35813 1/20 0.34
PPARA Q07869 3/20 0.33
PPARD Q03181 2/20 0.33
CACNA1B Q00975 2/20 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
SCHEMBL3689854 0.92 HTR6 (0.40) CMA1
SCHEMBL3688486 0.91 KDM4E (0.35) CMA1PPARGPPARAPPARD
SCHEMBL3686015 0.86 CMA1 (0.38) PER2CRY1CRY2CMA1PPARG
SCHEMBL3684613 0.86 PPARG (0.34) PER2CRY1CRY2CMA1PPARG
SCHEMBL3681651 0.78 PPARD (0.42) CMA1PPARGPPARAPPARD
SCHEMBL3690427 0.78 HTR6 (0.41) CMA1
SCHEMBL3682153 0.77 PPARD (0.44) CMA1PPARGPPARAPPARD
SCHEMBL3688162 0.77 ALDH1A1 (0.45) PPARGPPARA
SCHEMBL3683155 0.76 MCL1 (0.34) PPARGPPARAPPARD
SCHEMBL13508324 0.75 PPARG (0.43) CMA1PPARGPPARAPPARD

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 6 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
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 PER2 782/4885CRY1 1905/4885CRY2 2225/4885

“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.