SCHEMBL3092849

SCHEMBL3092849

CCN(C(=O)C(Cc1ccc([N+](=O)[O-])cc1)C(=O)NS(=O)(=O)c1cccc(-c2ccccc2)c1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.44
MMP2 P08253 6/20 0.44
MMP9 P14780 6/20 0.44
MMP8 P22894 6/20 0.44
MMP13 P45452 6/20 0.44
LARS1 Q9P2J5 1/20 0.43
BCL2 P10415 8/20 0.42
ITGB3 P05106 1/20 0.42
ITGAV P06756 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41

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
SCHEMBL3092359 0.90 LARS1 (0.44) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3091525 0.87 LARS1 (0.48) LARS1BCL2ALDH1A1MCL1BCL2L1
SCHEMBL3101091 0.86 ITGB3 (0.51) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3100860 0.85 ALDH1A1 (0.43) MMP1MMP2MMP9MMP8MMP13
SCHEMBL15000273 0.83 BCL2 (0.48) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3097165 0.83 LARS1 (0.45) LARS1MCL1BCL2L1
SCHEMBL3097037 0.83 ALDH1A1 (0.46) ALDH1A1
SCHEMBL3103784 0.83 MAPT (0.46) MMP2ALDH1A1
SCHEMBL3097895 0.82 LARS1 (0.43) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3083948 0.80 MAPT (0.44) MMP1MMP2MMP9MMP8MMP13

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 MMP1 1303/4885MMP2 1682/4885MMP9 1227/4885

“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.