SCHEMBL3097141

SCHEMBL3097141

CCN(CCOC)C(=O)C(Cc1cnn(Cc2ccccc2)c1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.39
LARS1 Q9P2J5 1/20 0.38
SCD O00767 2/20 0.36
SCD5 Q86SK9 2/20 0.36
PLG P00747 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RAPGEF3 O95398 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
KLKB1 P03952 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PTGER4 P35408 1/20 0.35
NR1I2 O75469 1/20 0.34

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
SCHEMBL3090643 0.92 LARS1 (0.43) LARS1SCDSCD5PLGALDH1A1
Trifluoroacetic Acid SCHEMBL3091304 0.87 LARS1 (0.37) LARS1PLGNR1I2
SCHEMBL3096206 0.85 LARS1 (0.41) LARS1SCDSCD5PLGALDH1A1
SCHEMBL3090411 0.84 LARS1 (0.40) LARS1PLGALDH1A1KLKB1KDM4E
SCHEMBL3470358 0.84 LARS1 (0.46) LARS1SCDSCD5ALDH1A1NR1I2
SCHEMBL3093166 0.83 LARS1 (0.41) LARS1SCDSCD5PLGALDH1A1
SCHEMBL3091744 0.83 LARS1 (0.41) LARS1PLGALDH1A1KDM4E
SCHEMBL3093093 0.83 MMP8 (0.43) LARS1SCDSCD5PLGALDH1A1
SCHEMBL3103667 0.82 LARS1 (0.40) LARS1SCDSCD5PLGALDH1A1
SCHEMBL3103273 0.80 LARS1 (0.39) LARS1PLGALDH1A1RAPGEF3

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 BCHE 2443/4885LARS1 1976/4885SCD 504/4885

“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.