SCHEMBL3097449

SCHEMBL3097449

CCCC(C(=O)O)C(=O)NS(=O)(=O)C=Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
GAA P10253 3/20 0.53
POLB P06746 2/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
PPARG P37231 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PKM P14618 1/20 0.40
TARS1 P26639 1/20 0.39
HSP90AA1 P07900 2/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL3097444 1.00 HTT (0.55) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3103883 0.89 PPARG (0.47) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3103890 0.89 PPARG (0.47) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3097109 0.84 HTT (0.58) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3097106 0.84 HTT (0.58) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3083735 0.83 HTT (0.48) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3083733 0.83 HTT (0.48) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3097484 0.82 HTT (0.52) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3097489 0.82 HTT (0.52) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3089225 0.81 HTT (0.51) HTTGAAPOLBKMT2AALDH1A1

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 HTT 2793/4885GAA 272/4885POLB 4626/4885

“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.