SCHEMBL6833255

SCHEMBL6833255

COc1ccc(N(C(C)=O)S(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.71
MCOLN3 Q8TDD5 1/20 0.71
MAPT P10636 8/20 0.51
ALDH1A1 P00352 3/20 0.51
GAA P10253 2/20 0.51
MITF O75030 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.51
LMNA P02545 4/20 0.49
TP53 P04637 4/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
CYP3A4 P08684 2/20 0.45
CYP2C19 P33261 2/20 0.45
THRB P10828 1/20 0.45

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
SCHEMBL6832001 0.84 POLB (0.79) POLBMCOLN3MAPTALDH1A1HTT
SCHEMBL6831728 0.81 POLB (0.74) POLBMCOLN3MAPTALDH1A1HTT
SCHEMBL10805165 0.77 POLB (0.68) POLBMCOLN3MAPTALDH1A1GAA
SCHEMBL9396448 0.76 POLB (0.55) POLBMCOLN3MAPTALDH1A1LMNA
SCHEMBL9681463 0.74 POLB (0.63) POLBMCOLN3MAPTALDH1A1LMNA
SCHEMBL11346104 0.74 POLB (0.51) POLBMCOLN3MAPTALDH1A1MEN1
SCHEMBL28711841 0.71 POLB (0.57) POLBMCOLN3MAPTMEN1KMT2A
SCHEMBL6831307 0.71 MCOLN3 (0.77) POLBMCOLN3MAPTALDH1A1GAA
SCHEMBL7909935 0.71 MEN1 (0.52) POLBMCOLN3MAPTALDH1A1LMNA
SCHEMBL3991397 0.71 POLB (0.62) POLBMCOLN3MAPTALDH1A1PKM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023938-A1 Sulfonamide derivatives TABUCHI TAKANORI (JP) 2004-02-05 US disclosed
US-6586617-B1 Nontoxic microbiocides such as 4'-chloro-N-ethyl-2'-nitro-p-toluenesulfonanilide, for agricultural or horticultural, prepared by alkylation or nitration SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2003-07-01 US disclosed
EP-1174028-A1 SULFONAMIDE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2002-01-23 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-20040023938-A1 Sulfonamide derivatives FPR1, MRM1, SULT1E1 POLB 3871/4885MCOLN3 3672/4885MAPT 4869/4885

“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.