SCHEMBL3097776

SCHEMBL3097776

C=CCC(C(=O)NS(=O)(=O)/C=C/c1ccccc1)C(=O)N(CC)CC

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 3/20 0.41
KMT2A Q03164 3/20 0.38
TARS1 P26639 3/20 0.37
ALDH1A1 P00352 5/20 0.37
LMNA P02545 3/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RRM1 P23921 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPARG P37231 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
SCHEMBL3097783 1.00 HTT (0.43) HTTNPC1L3MBTL1GAAKMT2A
SCHEMBL3083728 0.88 HTT (0.41) HTTGAAKMT2ATARS1ALDH1A1
SCHEMBL3083726 0.88 HTT (0.41) HTTGAAKMT2ATARS1ALDH1A1
SCHEMBL3092765 0.88 HTT (0.43) HTTGAAKMT2AALDH1A1LMNA
SCHEMBL3092776 0.88 HTT (0.43) HTTGAAKMT2AALDH1A1LMNA
SCHEMBL3089222 0.86 HTT (0.51) HTTGAAKMT2AALDH1A1LMNA
SCHEMBL3089225 0.86 HTT (0.51) HTTGAAKMT2AALDH1A1LMNA
SCHEMBL3096349 0.84 KMT2A (0.41) HTTGAAKMT2ATARS1POLB
SCHEMBL3097451 0.84 HTT (0.38) HTTGAAKMT2ATARS1ALDH1A1
SCHEMBL3086056 0.84 HTT (0.38) HTTGAATARS1RRM1PPARG

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 2793/4885NPC1 3306/4885L3MBTL1 4273/4885

“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.