SCHEMBL830857

SCHEMBL830857

COc1ccc(NS(=O)(=O)c2cc3ccccc3sc2=O)cc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.45
HSP90AB1 P08238 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 3/20 0.43
HTT P42858 3/20 0.43
ACLY P53396 2/20 0.43
BRD4 O60885 2/20 0.42
BRD2 P25440 1/20 0.42
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B2 P37059 2/20 0.41
HPGD P15428 2/20 0.41
HSD11B1 P28845 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL829708 0.87 TP53 (0.48) HSP90AA1HSP90AB1SMN1; SMN2HTTBRD4
SCHEMBL830171 0.86 BRD4 (0.48) HSP90AA1HSP90AB1SMN1; SMN2HTTBRD4
SCHEMBL829834 0.82 HTT (0.50) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL829597 0.76 KMT2A (0.47) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL7171823 0.74 HTR6 (0.62) L3MBTL1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL829745 0.74 PKM (0.43) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL7235930 0.72 SMN1; SMN2 (0.50) L3MBTL1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL7541078 0.71 SMN1; SMN2 (0.51) L3MBTL1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL830240 0.70 BRD4 (0.59) HSP90AA1HSP90AB1MAPTHTTBRD4
SCHEMBL6676339 0.69 MEN1 (0.56) L3MBTL1MEN1KMT2ASMN1; SMN2MAPT

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 HSP90AA1 1953/4885HSP90AB1 1349/4885L3MBTL1 2204/4885

“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.