SCHEMBL6767115

SCHEMBL6767115

CN(CCOc1ccc(CC2NC(=O)SC2=O)cc1)c1cccc(Oc2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.49
PPARA Q07869 2/20 0.47
RARG P13631 1/20 0.46
RXRA P19793 1/20 0.46
LTA4H P09960 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL6765220 0.93 PPARG (0.46) PPARGPPARARARGRXRAKDM4E
SCHEMBL1415411 0.88 PPARG (0.44) PPARGPPARARARGRXRALTA4H
SCHEMBL602342 0.84 PPARG (0.67) PPARGPPARARARGRXRAKDM4E
SCHEMBL1415588 0.83 PPARG (0.43) PPARGPPARARARGRXRALTA4H
SCHEMBL6606406 0.83 PPARG (0.66) PPARGPPARARARGRXRAKDM4E
Hydrochloric Acid SCHEMBL28341874 0.83 PPARG (0.66) PPARGPPARARARGRXRAKDM4E
SCHEMBL9325005 0.82 PPARG (0.48) PPARGPPARARARGRXRALTA4H
SCHEMBL1415555 0.80 PPARG (0.42) PPARGPPARARARGRXRAHRH3
SCHEMBL1415517 0.80 PPARG (0.42) PPARGPPARARARGRXRAALDH1A1
SCHEMBL1415361 0.80 PPARG (0.42) PPARGPPARARARGRXRAALDH1A1

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-6787551-B2 ORAL ADMINISTRATION; TREATING INSULIN RESISTANCE USING A NEW MECHANISM TO LOWER BLOOD SUGAR LEVEL BY INCREASING PHYSIOLOG-ICAL EFFECTS OF INSULIN ON TARGET CELLS (MUSCLE, ADIPOCYTES, LIVER); ALSO STRONGER ANTILIPIDEMIC THAN ROSIGLITAZONE CHONG KUN DANG PHARMACEUTICAL CORPORATION (KR) 2004-09-07 US claimed