SCHEMBL3683155

SCHEMBL3683155

CCCN(CCOc1ccc2c(ccn2C(C)C(=O)O)c1)S(=O)(=O)c1sc2ccccc2c1C

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
ITGB3 P05106 6/20 0.34
ITGAV P06756 6/20 0.34
PPARG P37231 3/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ALK Q9UM73 1/20 0.32
KCNA5 P22460 1/20 0.32
KCNJ5 P48544 1/20 0.32
KCNJ3 P48549 1/20 0.32
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
PTPN1 P18031 1/20 0.31
PRNP P04156 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL3684613 0.91 PPARG (0.34) ITGB3ITGAVPPARGPPARDPPARA
SCHEMBL3690103 0.86 OXER1 (0.33) ITGB3ITGAVPPARGKMT2AKDM4E
SCHEMBL3688486 0.85 KDM4E (0.35) MCL1PPARGKMT2AMEN1KDM4E
SCHEMBL13509420 0.81 MAPT (0.36) PPARGALDH1A1ALKPPARA
SCHEMBL3693301 0.79 ITGB3 (0.39) ITGB3ITGAVPPARGALDH1A1
SCHEMBL3688815 0.77 CMA1 (0.36)
SCHEMBL3690480 0.76 HTR6 (0.39)
SCHEMBL3689331 0.76 PER2 (0.36) PPARGPPARDPPARA
SCHEMBL3689854 0.76 HTR6 (0.40)
SCHEMBL13509470 0.72 CMA1 (0.34) PPARGALDH1A1PPARA

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 4 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
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 MCL1 4406/4885ITGB3 4630/4885ITGAV 4603/4885

“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.