SCHEMBL3084787

SCHEMBL3084787

CCN(C(=O)C(Cc1ccc(C(=O)OC)cc1)C(=O)NS(=O)(=O)/C=C/c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.40
PTPN1 P18031 1/20 0.39
CDC25B P30305 1/20 0.39
DUSP3 P51452 1/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.37
RRM1 P23921 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RAB9A P51151 1/20 0.36
NR1H4 Q96RI1 1/20 0.35
LMNA P02545 1/20 0.35
PTPRB P23467 1/20 0.35
ITGB3 P05106 1/20 0.35

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
SCHEMBL3084789 1.00 PPARG (0.40) PPARGPTPN1CDC25BDUSP3TP53
SCHEMBL3083960 0.92 KMT2A (0.45) PPARGALDH1A1POLBRRM1HDAC1
SCHEMBL3083962 0.92 KMT2A (0.45) PPARGALDH1A1POLBRRM1HDAC1
SCHEMBL3092640 0.91 ALDH1A1 (0.46) PPARGALDH1A1POLBHTTKMT2A
SCHEMBL3092630 0.91 ALDH1A1 (0.46) PPARGALDH1A1POLBHTTKMT2A
SCHEMBL15000113 0.90 PPARG (0.42) PPARGPTPN1CDC25BDUSP3ALDH1A1
SCHEMBL15000115 0.90 PPARG (0.42) PPARGPTPN1CDC25BDUSP3ALDH1A1
SCHEMBL3100032 0.88 ALDH1A1 (0.43) PPARGALDH1A1POLBKMT2ANR1H4
SCHEMBL3100158 0.88 KMT2A (0.41) ALDH1A1POLBHTTSMN1; SMN2KMT2A
SCHEMBL3100420 0.88 POLB (0.41) ALDH1A1POLBHDAC1HDAC6HTT

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 PPARG 136/4885PTPN1 850/4885CDC25B 4036/4885

“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.