SCHEMBL831473

SCHEMBL831473

O=c1sc2cc(Cl)ccc2cc1S(=O)(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 5/20 0.39
ERCC1 P07992 1/20 0.36
ERCC4 Q92889 1/20 0.36
KMT2A Q03164 2/20 0.36
IDO1 P14902 1/20 0.35
F10 P00742 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL829109 0.90 GRM4 (0.41) GRM4ERCC1ERCC4KMT2AMEN1
SCHEMBL829697 0.84 F10 (0.38) KMT2AF10CYP3A4CYP2C9MAPK1
SCHEMBL829579 0.79 CYP3A4 (0.40) KMT2AF10CYP3A4MEN1ALDH1A1
SCHEMBL831074 0.78 CA2 (0.36) KMT2AF10MEN1NPC1ALDH1A1
SCHEMBL830560 0.78 EPHX2 (0.36) GRM4ERCC1ERCC4KMT2AMAPK1
SCHEMBL830871 0.77 MEN1 (0.42) GRM4KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL830441 0.76 TXNRD1 (0.40) CYP1A2CYP3A4CYP2C9MAPK1CYP2C19
SCHEMBL830341 0.74 DAO (0.48) ERCC1ERCC4KMT2A
SCHEMBL830657 0.72 KDM4E (0.41) GRM4KMT2ACYP3A4CYP2C9MAPK1
SCHEMBL1369241 0.72 CA12 (0.39) ERCC1ERCC4KMT2AMAPK1MEN1

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-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
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 GRM4 4399/4885ERCC1 3287/4885ERCC4 1812/4885

“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.