SCHEMBL3089115

SCHEMBL3089115

CCN(C(=O)C(Cc1ccc(OC)nc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXTR P30559 3/20 0.46
RAPGEF3 O95398 1/20 0.42
TAS2R14 Q9NYV8 1/20 0.42
LARS1 Q9P2J5 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NAMPT P43490 1/20 0.40
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
MMP1 P03956 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
ADAM17 P78536 1/20 0.39
F2 P00734 1/20 0.39
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CNR2 P34972 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.36

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
SCHEMBL14999925 0.90 RAPGEF3 (0.45) OXTRRAPGEF3TAS2R14LARS1ALDH1A1
SCHEMBL3100322 0.88 KDM4E (0.49) RAPGEF3LARS1ALDH1A1KMT2AKDM4E
SCHEMBL3097161 0.85 PDE4D (0.46) RAPGEF3TAS2R14LARS1ALDH1A1KMT2A
SCHEMBL3097466 0.85 KDM4E (0.47) RAPGEF3LARS1ALDH1A1KMT2AKDM4E
SCHEMBL3092629 0.84 POLB (0.55) RAPGEF3LARS1ALDH1A1KMT2AKDM4E
SCHEMBL3086151 0.83 SLC16A3 (0.47) LARS1POLBF2CNR2CYSLTR1
SCHEMBL3083515 0.83 LARS1 (0.46) LARS1KMT2APOLBLMNAF2
SCHEMBL3093111 0.83 LARS1 (0.46) LARS1KMT2APOLBLMNAMMP1
SCHEMBL3103912 0.83 LARS1 (0.46) RAPGEF3LARS1ALDH1A1KMT2ALMNA
SCHEMBL3086148 0.83 LARS1 (0.46) LARS1KMT2APOLBLMNAF2

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 OXTR 1858/4885RAPGEF3 2094/4885TAS2R14 1309/4885

“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.