SCHEMBL5380813

SCHEMBL5380813

CCOC(=O)[C@H](Cc1ccc(OCCCOc2ccc(-c3ccc(O[Si](C)(C)C(C)(C)C)cc3)cc2)cc1)OC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.55
PPARG P37231 10/20 0.55
PPARD Q03181 9/20 0.55
NPSR1 Q6W5P4 1/20 0.42
DHFR P00374 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PREP P48147 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
HRH2 P25021 1/20 0.37
HRH1 P35367 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
SCHEMBL5377838 1.00 PPARA (0.55) PPARAPPARGPPARDNPSR1DHFR
SCHEMBL14366577 0.94 PPARA (0.55) PPARAPPARGPPARDNPSR1MEN1
SCHEMBL5379980 0.88 PPARA (0.49) PPARAPPARGPPARDNPSR1MEN1
SCHEMBL14560622 0.84 PPARA (0.64) PPARAPPARGPPARDNPSR1MEN1
SCHEMBL5380276 0.84 PPARG (0.56) PPARAPPARGPPARDNPSR1MEN1
SCHEMBL13847884 0.82 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL5379986 0.81 PPARG (0.73) PPARAPPARGPPARD
SCHEMBL14366394 0.81 PREP (0.41) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL14560652 0.81 PPARA (0.56) PPARAPPARGPPARDNPSR1MEN1
SCHEMBL5395165 0.81 PPARD (0.59) PPARAPPARGPPARDDHFRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 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 (2 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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA PPARA 3/4885PPARG 2/4885PPARD 7/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARA 3/4885PPARG 1/4885PPARD 4/4885

“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.