SCHEMBL6060930

SCHEMBL6060930

O=C1NC(=O)C(Cc2cc3ccc(Cc4ccccc4)cc3[nH]c2=O)S1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.49
FFAR1 O14842 5/20 0.43
MAPT P10636 1/20 0.42
FEN1 P39748 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
IL4I1 Q96RQ9 1/20 0.40
PPARA Q07869 1/20 0.40
CA2 P00918 2/20 0.40
MAOB P27338 1/20 0.40
MAOA P21397 1/20 0.40
CISD1 Q9NZ45 1/20 0.40
PTPN1 P18031 1/20 0.39
KMT2A Q03164 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
SCHEMBL96600 0.83 PPARG (0.48) PPARGMAPTALDH1A1NPSR1IL4I1
SCHEMBL13846781 0.73 KDM4E (0.52) MAPTALDH1A1NPSR1CA2MAOB
SCHEMBL166570 0.72 PPARG (0.74) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL290413 0.72 MAPT (0.75) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL13846771 0.70 CA2 (0.63) PPARGMAPTALDH1A1CA2
SCHEMBL13846702 0.70 PPARG (0.59) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL13846766 0.70 KDM4E (0.53) ALDH1A1NPSR1MAOBMAOACISD1
SCHEMBL6866703 0.70 PPARG (0.71) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL8932685 0.68 HDAC8 (0.53) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL9372697 0.68 PPARG (0.68) PPARGFFAR1MAPTALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060167045-A1 Combination therapy using a dual ppar alpha/gamma agonist and an angiotensin II type I receptor antagonist MERCK & CO., INC. 2006-07-27 US 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-20060167045-A1 Combination therapy using a dual ppar alpha/gamma agonist and an angiotensin II type I receptor antagonist AGTR2, AGTR1, PPARA PPARG 4/4885FFAR1 15/4885MAPT 3741/4885

“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.