SCHEMBL830278

SCHEMBL830278

Cc1cccc2[nH]c(=O)c(S(=O)(=O)c3cc4c(C)cccc4[nH]c3=O)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 4/20 0.61
DDO Q99489 4/20 0.61
CYP1A2 P05177 3/20 0.43
TNKS2 Q9H2K2 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP2C19 P33261 1/20 0.43
BRD4 O60885 1/20 0.42
PARP1 P09874 2/20 0.40
FLT3 P36888 2/20 0.40
PDGFRB P09619 1/20 0.40
KIT P10721 1/20 0.40
KIF11 P52732 1/20 0.40
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 1/20 0.39
TNKS O95271 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GPR3 P46089 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39

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
SCHEMBL20247282 0.80 DAO (0.71) DAODDOCYP1A2TNKS2KMT2A
SCHEMBL30667289 0.80 DAO (0.71) DAODDOCYP1A2TNKS2KMT2A
SCHEMBL831150 0.80 KMT2A (0.59) TNKS2KMT2ABRD4FLT3KDM4E
SCHEMBL3423807 0.76 DAO (1.00) DAODDOCYP1A2TNKS2CYP2C19
SCHEMBL31139816 0.76 DAO (0.65) DAODDOCYP1A2TNKS2KMT2A
SCHEMBL3423473 0.73 DAO (0.61) DAODDOCYP1A2TNKS2KMT2A
SCHEMBL831363 0.73 DAO (0.61) DAODDOKMT2AKDM4EALDH1A1
SCHEMBL31606374 0.72 DAO (0.59) DAODDOCYP1A2TNKS2KMT2A
SCHEMBL829945 0.72 DAO (0.56) DAODDOCYP1A2KMT2ABRD4
SCHEMBL8230643 0.70 DAO (0.56) DAODDOCYP1A2TNKS2KMT2A

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 DAO 3359/4885DDO 1479/4885CYP1A2 1184/4885

“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.