SCHEMBL831153

SCHEMBL831153

O=c1oc2c(O)cccc2cc1S(=O)(=O)c1cc2cccc(O)c2oc1=O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.79
CA1 P00915 5/20 0.79
CA2 P00918 5/20 0.79
CA9 Q16790 5/20 0.79
MAOA P21397 4/20 0.57
ADORA2A P29274 5/20 0.55
ADORA1 P30542 5/20 0.55
ADORA3 P0DMS8 3/20 0.55
MAOB P27338 3/20 0.55
MEN1 O00255 1/20 0.54
PABPC1 P11940 1/20 0.54
KMT2A Q03164 1/20 0.54
ATM Q13315 1/20 0.54
ERAP1 Q9NZ08 1/20 0.54
TMIGD3 P0DMS9 3/20 0.50
RXFP1 Q9HBX9 1/20 0.47
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL20440775 0.89 ATM (0.69) CA12CA1CA2CA9MAOA
SCHEMBL830863 0.81 ADORA3 (0.56) CA12CA1CA2CA9MAOA
SCHEMBL20758946 0.77 CA12 (0.60) CA12CA1CA2CA9MAOA
SCHEMBL10794144 0.75 MAOA (0.63) CA12CA1CA2CA9MAOA
SCHEMBL10791365 0.75 MAOA (0.60) CA12CA1CA2CA9MAOA
SCHEMBL10790876 0.75 CA12 (0.63) CA12CA1CA2CA9MAOA
SCHEMBL15628851 0.75 CA12 (0.63) CA12CA1CA2CA9MAOA
SCHEMBL10795099 0.75 MAOA (0.60) CA12CA1CA2CA9MAOA
SCHEMBL830725 0.74 CA12 (0.82) CA12CA1CA2CA9ADORA2A
SCHEMBL831076 0.74 RXFP1 (0.51) CA12CA1CA2CA9MAOA

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 CA12 2448/4885CA1 3859/4885CA2 2552/4885

“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.