SCHEMBL3093531

SCHEMBL3093531

CCN(C(=O)C(CCCc1ccc(OC)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 1/20 0.51
RAPGEF3 O95398 1/20 0.46
MMP1 P03956 6/20 0.44
MMP9 P14780 2/20 0.44
MMP13 P45452 2/20 0.44
ADAM17 P78536 1/20 0.44
MMP3 P08254 5/20 0.43
MMP2 P08253 4/20 0.43
PDE4A P27815 4/20 0.43
PDE4B Q07343 4/20 0.43
PDE4C Q08493 4/20 0.43
PDE4D Q08499 4/20 0.43
LARS1 Q9P2J5 1/20 0.43
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 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
SCHEMBL3090585 0.95 ALDH1A1 (0.52) ALDH1A1KDM4EKMT2ARAPGEF3MMP1
SCHEMBL3093756 0.92 LARS1 (0.46) ALDH1A1KDM4EKMT2ARAPGEF3LARS1
SCHEMBL3093369 0.91 LARS1 (0.44) ALDH1A1KDM4EKMT2AMMP13LARS1
SCHEMBL3080463 0.90 LARS1 (0.43) ALDH1A1KDM4EKMT2ALARS1LMNA
SCHEMBL3100322 0.89 KDM4E (0.49) ALDH1A1KDM4EKMT2ARAPGEF3MMP1
SCHEMBL3090337 0.88 POLB (0.44) ALDH1A1KDM4EKMT2ALARS1LMNA
SCHEMBL3097466 0.87 KDM4E (0.47) ALDH1A1KDM4EKMT2ARAPGEF3MMP1
SCHEMBL3100295 0.86 LARS1 (0.47) ALDH1A1KDM4EKMT2ARAPGEF3LARS1
SCHEMBL3093370 0.86 LARS1 (0.45) ALDH1A1KDM4EKMT2AMMP13LARS1
SCHEMBL3096411 0.85 LARS1 (0.45) ALDH1A1KDM4EKMT2ARAPGEF3MMP1

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 ALDH1A1 617/4885KDM4E 3644/4885KMT2A 1948/4885

“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.