SCHEMBL830439

SCHEMBL830439

CCOc1cccc2cc(S(=O)(=O)Nc3ccc(OC)cc3)c(=O)sc12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.52
HTT P42858 3/20 0.48
TP53 P04637 1/20 0.48
LMNA P02545 8/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALDH1A1 P00352 7/20 0.47
HPGD P15428 3/20 0.47
PKM P14618 1/20 0.47
MAPT P10636 3/20 0.46
POLB P06746 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALPL P05186 2/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL831019 0.82 LMNA (0.43) SMN1; SMN2HTTTP53LMNANPSR1
SCHEMBL830023 0.79 CA2 (0.49) LMNAALDH1A1PKMMAPTMEN1
SCHEMBL830559 0.79 CA12 (0.64) SMN1; SMN2HTTTP53LMNANPSR1
SCHEMBL829834 0.78 HTT (0.50) SMN1; SMN2HTTTP53LMNANPSR1
SCHEMBL831145 0.77 CA2 (0.47) TP53LMNAALDH1A1PKMMAPT
SCHEMBL831287 0.77 MAOA (0.41) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL830222 0.77 MAOA (0.41) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL830221 0.77 MAOA (0.41) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL830747 0.75 MAOA (0.45) HTTLMNAALDH1A1MAPTMEN1
SCHEMBL830658 0.70 PGR (0.51) SMN1; SMN2HTTTP53LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 SMN1; SMN2 1066/4885HTT 2736/4885TP53 114/4885

“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.