SCHEMBL4784539

SCHEMBL4784539

O=S(=O)(Nc1ccc2c(c1)OCCO2)c1cccc(C(F)(F)F)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.80
KMT2A Q03164 3/20 0.71
LMNA P02545 4/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MEN1 O00255 2/20 0.62
IDH1 O75874 1/20 0.60
PKM P14618 1/20 0.60
PKLR P30613 1/20 0.60
ALDH1A1 P00352 3/20 0.58
HSD17B2 P37059 1/20 0.58
HTT P42858 2/20 0.57
GAA P10253 1/20 0.57
HPGD P15428 2/20 0.56
NR3C1 P04150 1/20 0.56
PGR P06401 1/20 0.56
AR P10275 1/20 0.56
ESR2 Q92731 1/20 0.56
TSHR P16473 2/20 0.55
USP2 O75604 1/20 0.55
TP53 P04637 1/20 0.55

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
SCHEMBL3017181 0.81 KMT2A (0.72) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL5229376 0.81 MAPT (0.81) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL12846033 0.80 KMT2A (0.71) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL4784250 0.78 MAPT (0.70) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL6476587 0.78 MAPT (0.54) MAPTKMT2ALMNASMN1; SMN2PKM
SCHEMBL7572806 0.77 NR3C1 (0.69) MAPTKMT2ALMNAMEN1IDH1
SCHEMBL3762909 0.77 PGR (0.77) MAPTKMT2AMEN1HSD17B2GAA
SCHEMBL4732936 0.77 MAPT (0.69) MAPTKMT2ALMNASMN1; SMN2MEN1
SCHEMBL7571567 0.76 HSD17B2 (0.63) MAPTKMT2ALMNAMEN1ALDH1A1
SCHEMBL7573925 0.76 HSD17B2 (0.79) MAPTKMT2ALMNAMEN1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053995-A1 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-03-03 US claimed
WO-2008061247-A2 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENT OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 WO claimed
US-20110053995-A1 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-03-03 US disclosed
US-20110053995-A1 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-03-03 US disclosed
WO-2008061247-A2 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENT OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 WO disclosed
WO-2008061247-A2 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS THE REGENT OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-22 WO 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-20110053995-A1 BENZENESULFONANILIDE COMPOUND INHIBITORS OF UREA TRANSPORTERS SLC14A1, SLC2A1, SLC2A4 MAPT 2445/4885KMT2A 4539/4885LMNA 3349/4885

“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.