SCHEMBL3103883

SCHEMBL3103883

CCCC(C(=O)NS(=O)(=O)/C=C/c1ccccc1)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47
HTT P42858 1/20 0.46
GAA P10253 4/20 0.46
MMP8 P22894 2/20 0.45
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 3/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.40
CTDSP1 Q9GZU7 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
SCHEMBL3103890 1.00 PPARG (0.47) PPARGHTTGAAMMP8TDP1
SCHEMBL3097449 0.89 HTT (0.55) PPARGHTTGAATDP1LMNA
SCHEMBL3097444 0.89 HTT (0.55) PPARGHTTGAATDP1LMNA
SCHEMBL3093774 0.88 PPARG (0.43) PPARGHTTGAAMMP8TDP1
SCHEMBL3093767 0.88 PPARG (0.43) PPARGHTTGAAMMP8TDP1
SCHEMBL3090545 0.85 PPARG (0.45) PPARGHTTGAAMMP8TDP1
SCHEMBL3090541 0.85 PPARG (0.45) PPARGHTTGAAMMP8TDP1
SCHEMBL3090514 0.82 MMP8 (0.54) PPARGHTTMMP8LMNAALDH1A1
SCHEMBL3085272 0.82 MMP8 (0.54) PPARGHTTGAAMMP8ALDH1A1
SCHEMBL3085269 0.82 MMP8 (0.54) PPARGHTTGAAMMP8ALDH1A1

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
EP-2172450-B9 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2014-10-08 EP disclosed
EP-2172450-B1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2013-10-16 EP disclosed
US-8461209-B2 Malonic acid sulfonamide derivative and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-06-11 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 US disclosed
EP-2172450-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2010-04-07 EP 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-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 PPARG 136/4885HTT 2793/4885GAA 272/4885

“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.