SCHEMBL5386040

SCHEMBL5386040

CO[C@@H](Cc1ccc(OCCOc2ccc(C(C)(C)c3ccccc3)cc2)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.67
PPARD Q03181 8/20 0.67
PPARA Q07869 8/20 0.67
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 8/20 0.53
POLB P06746 1/20 0.53
ALDH1A1 P00352 5/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
HTT P42858 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
LMNA P02545 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
GAA P10253 1/20 0.50

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
SCHEMBL5399900 0.96 PPARG (0.73) PPARGPPARDPPARASMN1; SMN2KDM4E
SCHEMBL6526812 0.96 PPARG (0.73) PPARGPPARDPPARASMN1; SMN2KDM4E
SCHEMBL14571354 0.93 PPARG (0.65) PPARGPPARDPPARASMN1; SMN2KDM4E
SCHEMBL14392082 0.91 PPARA (0.60) PPARGPPARDPPARAKDM4EPOLB
SCHEMBL5394822 0.88 PPARG (0.84) PPARGPPARDPPARA
SCHEMBL5375372 0.87 PPARG (0.78) PPARGPPARDPPARASMN1; SMN2KDM4E
SCHEMBL27654978 0.87 PPARA (0.76) PPARGPPARDPPARA
SCHEMBL5377110 0.85 PPARA (0.61) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL5377329 0.85 PPARG (0.71) PPARGPPARDPPARASMN1; SMN2ALDH1A1
SCHEMBL5382586 0.85 PPARA (0.63) PPARGPPARDPPARA

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 2/4885PPARD 7/4885PPARA 3/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARG 1/4885PPARD 4/4885PPARA 3/4885

“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.