SCHEMBL3085528

SCHEMBL3085528

C#CCC(C(=O)NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 1/20 0.53
GAA P10253 2/20 0.49
RAPGEF3 O95398 1/20 0.46
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
NLRP3 Q96P20 1/20 0.45
KAT6A Q92794 4/20 0.43
HIF1A Q16665 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CTSS P25774 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL3092392 0.86 LARS1 (0.56) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL15000274 0.83 LARS1 (0.52) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3093748 0.83 LARS1 (0.54) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3091388 0.83 MMP8 (0.58) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3096612 0.83 LARS1 (0.51) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3097194 0.82 LARS1 (0.53) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3097004 0.82 LARS1 (0.50) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3085527 0.80 LARS1 (0.48) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3093170 0.80 ALDH1A1 (0.54) LARS1GAARAPGEF3ALDH1A1KMT2A
SCHEMBL3100450 0.80 LARS1 (0.53) LARS1GAARAPGEF3ALDH1A1KMT2A

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 LARS1 1976/4885GAA 272/4885RAPGEF3 2094/4885

“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.