SCHEMBL3103556

SCHEMBL3103556

CCC(CC)(C(N)=O)C(=O)NS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
LMNA P02545 1/20 0.50
EGFR P00533 5/20 0.49
F2 P00734 1/20 0.49
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
MMP9 P14780 2/20 0.49
MMP13 P45452 2/20 0.49
MMP2 P08253 2/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
MMP1 P03956 1/20 0.49
MMP8 P22894 1/20 0.49
ERBB2 P04626 4/20 0.48
GAA P10253 1/20 0.48
FLT1 P17948 1/20 0.47
FLT4 P35916 1/20 0.47
KDR P35968 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL3097522 0.87 RAPGEF3 (0.57) ALDH1A1FLT1FLT4KDR
SCHEMBL3092148 0.86 MCL1 (0.53) MMP9MMP13MMP2MMP1
SCHEMBL3088414 0.85 ALDH1A1 (0.49) ALDH1A1LMNAEGFRF2PRSS1
SCHEMBL3085861 0.81 MMP1 (0.47) LMNAMMP9MMP13MMP2CA1
SCHEMBL3093141 0.79 LARS1 (0.53) ALDH1A1LMNAF2PRSS1PRSS2
SCHEMBL3083514 0.79 ALDH1A1 (0.49) ALDH1A1LMNACA1CA2GAA
SCHEMBL12862919 0.78 MMP2 (0.59) ALDH1A1EGFRF2PRSS1PRSS2
Hydrochloric Acid SCHEMBL3085657 0.78 LARS1 (0.52) ALDH1A1LMNAF2PRSS1PRSS2
SCHEMBL30620037 0.78 MMP2 (0.62) ALDH1A1LMNAEGFRF2PRSS1
SCHEMBL26041439 0.77 MMP2 (0.57) ALDH1A1EGFRF2PRSS1PRSS2

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
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-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 ALDH1A1 617/4885LMNA 3803/4885EGFR 346/4885

“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.