SCHEMBL13846702

SCHEMBL13846702

O=C1NC(=O)C(Cc2ccc3ccccc3c2)S1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.59
MAPT P10636 1/20 0.59
ALDH1A1 P00352 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
MAOA P21397 2/20 0.55
CISD1 Q9NZ45 2/20 0.55
FFAR1 O14842 7/20 0.54
MAOB P27338 1/20 0.52
PPARA Q07869 2/20 0.52
PTPN1 P18031 2/20 0.51
MPC2 O95563 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2C9 P11712 1/20 0.48
CA2 P00918 1/20 0.48

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
SCHEMBL7631727 0.87 MAPT (0.57) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL9564659 0.86 FFAR1 (0.62) PPARGFFAR1PPARAMPC2CYP2C8
SCHEMBL9435871 0.85 PPARG (0.46) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL13846731 0.83 CA2 (0.64) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL377496 0.82 FFAR1 (0.43) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL14281402 0.82 FFAR1 (0.43) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL9570559 0.82 MAPT (0.83) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL166570 0.80 PPARG (0.74) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL8315737 0.80 MAPT (0.57) PPARGMAPTALDH1A1NPSR1MAOA
SCHEMBL290976 0.80 UTRN (0.48) PPARGMAPTALDH1A1NPSR1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
EP-1585541-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING INSULIN AND LEGENDS OF INSULIN HEXAMER NOVO NORDISK AS (DK) 2007-11-14 EP 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB PPARG 1757/4885MAPT 1785/4885ALDH1A1 4836/4885

“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.