SCHEMBL830117

SCHEMBL830117

COc1ccc(NS(=O)(=O)c2cc3ccccc3[nH]c2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
MAPT P10636 3/20 0.58
ALDH1A1 P00352 2/20 0.58
GAA P10253 1/20 0.58
HIF1A Q16665 1/20 0.58
BRD4 O60885 2/20 0.54
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
CNR1 P21554 2/20 0.51
LMNA P02545 3/20 0.50
TP53 P04637 2/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
CDC25B P30305 1/20 0.49
HPGD P15428 1/20 0.49
CYP19A1 P11511 1/20 0.48
MEN1 O00255 1/20 0.48
ALOX12 P18054 1/20 0.48
KMT2A Q03164 1/20 0.48
PADI4 Q9UM07 1/20 0.47

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
SCHEMBL831273 0.84 PGR (0.51) ALDH1A1BRD4LMNATP53HTT
SCHEMBL831112 0.83 POLB (0.48) MAPTBRD4TP53MEN1KMT2A
SCHEMBL830538 0.78 CNR1 (0.54) KDM4EMAPTALDH1A1GAAHIF1A
SCHEMBL830281 0.76 BRD4 (0.47) MAPTALDH1A1GAABRD4NPC1
SCHEMBL5187428 0.76 PGR (0.64) KDM4EMAPTALDH1A1GAARAB9A
SCHEMBL829533 0.76 PADI4 (0.60) KDM4EMAPTALDH1A1GAAHIF1A
SCHEMBL830862 0.76 PADI4 (0.60) KDM4EMAPTALDH1A1GAAHIF1A
SCHEMBL830977 0.76 FFAR4 (0.43) BRD4LMNAKMT2A
SCHEMBL829532 0.76 PADI4 (0.60) KDM4EMAPTALDH1A1GAAHIF1A
SCHEMBL829834 0.75 HTT (0.50) MAPTALDH1A1GAALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232649-A1 Heteroaryl Sulfones and Sulfonamides and Therapeutic Uses Thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-10-04 US claimed
EP-1765804-A2 HETEROARYL SULFONES AND SULFONAMIDES AND THERAPEUTIC USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 2007-03-28 EP claimed
WO-2005123077-A2 HETEROARYL SULFONES AND SULFONAMIDES AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2005-12-29 WO claimed
US-8143428-B2 Heteroaryl sulfones and sulfonamides and therapeutic uses thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-03-27 US disclosed
US-20070232649-A1 Heteroaryl Sulfones and Sulfonamides and Therapeutic Uses Thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2007-10-04 US disclosed
EP-1765804-A2 HETEROARYL SULFONES AND SULFONAMIDES AND THERAPEUTIC USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 2007-03-28 EP disclosed
WO-2005123077-A2 HETEROARYL SULFONES AND SULFONAMIDES AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2005-12-29 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-20070232649-A1 Heteroaryl Sulfones and Sulfonamides and Therapeutic Uses Thereof SULT1E1, STS, CCNE1 KDM4E 1593/4885MAPT 4837/4885ALDH1A1 1141/4885

“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.