Benzene

Benzene

SCHEMBL5266290

Cc1ocnc1COc1cccc(CN(CC(=O)O)S(=O)(=O)C2CCc3ccccc3N2)c1.c1ccccc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.39
PPARG P37231 15/20 0.39
DAGLA Q9Y4D2 2/20 0.38
CYP2C9 P11712 4/20 0.37
KCNH2 Q12809 3/20 0.37
ABHD6 Q9BV23 1/20 0.37
CD274 Q9NZQ7 1/20 0.37

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
Benzene SCHEMBL5261549 0.92 PPARA (0.36) PPARAPPARGDAGLAABHD6
SCHEMBL5257672 0.87 PPARG (0.55) PPARAPPARGCYP2C9KCNH2
SCHEMBL5263653 0.85 PPARG (0.57) PPARAPPARGCYP2C9KCNH2
SCHEMBL5261024 0.82 PPARG (0.61) PPARAPPARG
SCHEMBL5229679 0.81 POLB (0.40) CD274
SCHEMBL5263067 0.80 PPARG (0.50) PPARAPPARGCYP2C9KCNH2
SCHEMBL5226126 0.79 PPARG (0.50) PPARAPPARG
SCHEMBL5263781 0.79 FFAR1 (0.51) PPARAPPARG
SCHEMBL5229193 0.78 PPARG (0.50) PPARAPPARGCYP2C9KCNH2
SCHEMBL5265017 0.78 PPARG (0.48) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254882-A1 Sulfamide Derivatives and Pharmaceutical Composition for Upregulation of Lipid Metabolism Comprising Same CRYSTAL GENOMICS, INC. (KR) 2007-11-01 US claimed
US-20070254882-A1 Sulfamide Derivatives and Pharmaceutical Composition for Upregulation of Lipid Metabolism Comprising Same CRYSTAL GENOMICS, INC. (KR) 2007-11-01 US disclosed
EP-1778654-A1 SULFAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR UPREGULATION OF LIPID METABOLISM COMPRISING SAME Crystalgenomics, Inc. (KR) 2007-05-02 EP disclosed
WO-2006006832-A1 SULFAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR UPREGULATION OF LIPID METABOLISM COMPRISING SAME CRYSTALGENOMICS, INC. (KR) 2006-01-19 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-20070254882-A1 Sulfamide Derivatives and Pharmaceutical Composition for Upregulation of Lipid Metabolism Comprising Same SULT2A1, SPTLC2, SGMS2 PPARA 190/4885PPARG 399/4885DAGLA 826/4885

“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.