SCHEMBL3090668

SCHEMBL3090668

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 1/20 0.56
SLC1A3 P43003 1/20 0.50
SLC1A2 P43004 1/20 0.50
SLC1A1 P43005 1/20 0.50
ALDH1A1 P00352 4/20 0.48
KAT6A Q92794 3/20 0.47
LMNA P02545 2/20 0.46
RAPGEF3 O95398 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NLRP3 Q96P20 1/20 0.45
CTSS P25774 1/20 0.44
F2 P00734 2/20 0.43
CYP19A1 P11511 1/20 0.43
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL3097194 0.86 LARS1 (0.53) LARS1ALDH1A1KAT6ALMNARAPGEF3
SCHEMBL3103936 0.85 LARS1 (0.49) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3090840 0.82 LARS1 (0.58) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3090045 0.81 LARS1 (0.57) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3092392 0.80 LARS1 (0.56) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3080433 0.79 LARS1 (0.46) LARS1ALDH1A1KAT6ALMNARAPGEF3
SCHEMBL3080656 0.79 LARS1 (0.58) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3103948 0.78 KAT6A (0.55) LARS1SLC1A3SLC1A2SLC1A1KAT6A
SCHEMBL3086119 0.78 LARS1 (0.54) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL1770658 0.78 MMP9 (0.48) LARS1SLC1A3SLC1A2SLC1A1ALDH1A1

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 1976/4885SLC1A3 713/4885SLC1A2 880/4885

“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.