SCHEMBL5379901

SCHEMBL5379901

CO[C@@H](Cc1ccc(OCCCOc2ccc(-c3ccc4c(c3)OCO4)cc2)cc1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.68
PPARA Q07869 9/20 0.68
PPARD Q03181 8/20 0.68
PTGER4 P35408 1/20 0.52
KCNH2 Q12809 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
LTB4R Q15722 1/20 0.45
MAPT P10636 2/20 0.45
ALDH1A1 P00352 1/20 0.45
PTPN1 P18031 1/20 0.44
EDNRB P24530 1/20 0.44
EDNRA P25101 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL5383385 0.92 PPARG (0.62) PPARGPPARAPPARDMAPTALDH1A1
SCHEMBL5380210 0.81 PPARG (1.00) PPARGPPARAPPARD
SCHEMBL5380219 0.81 PPARG (1.00) PPARGPPARAPPARD
SCHEMBL27674846 0.81 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL5383887 0.81 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL5383883 0.81 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL5386010 0.81 PPARG (0.83) PPARGPPARAPPARD
SCHEMBL5389900 0.81 PPARG (0.83) PPARGPPARAPPARD
SCHEMBL5395182 0.79 PPARA (0.81) PPARGPPARAPPARD
SCHEMBL5391227 0.79 PPARG (0.81) PPARGPPARAPPARD

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 7 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-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

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 PPARG 2/4885PPARA 3/4885PPARD 7/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARG 1/4885PPARA 3/4885PPARD 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.