SCHEMBL3092776

SCHEMBL3092776

C=CCC(C(=O)NS(=O)(=O)C=Cc1ccccc1)C(=O)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
GAA P10253 4/20 0.40
POLB P06746 2/20 0.38
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
CNR2 P34972 1/20 0.35
SNCA P37840 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL3092765 1.00 HTT (0.43) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3102641 0.89 TRPM8 (0.46) HTTGAAALDH1A1TDP1TRPM8
SCHEMBL3102646 0.89 TRPM8 (0.46) HTTGAAALDH1A1TDP1TRPM8
SCHEMBL3097776 0.88 HTT (0.43) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3097783 0.88 HTT (0.43) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3089222 0.85 HTT (0.51) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3089225 0.85 HTT (0.51) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3092698 0.81 HTT (0.41) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3083726 0.81 HTT (0.41) HTTGAAPOLBKMT2AALDH1A1
SCHEMBL3092691 0.81 HTT (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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.