SCHEMBL5850827

SCHEMBL5850827

COC(=O)CCc1ccc(OC(C)c2oc(-c3ccc(OC(F)(F)F)cc3)nc2C(C)C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.39
PPARG P37231 6/20 0.39
PPARD Q03181 8/20 0.38
IDH1 O75874 3/20 0.38
HDAC3 O15379 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
PTGER4 P35408 1/20 0.36
SCN10A Q9Y5Y9 3/20 0.36
SCN2A Q99250 1/20 0.36
CETP P11597 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
VDR P11473 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
SCHEMBL5850985 0.91 PPARA (0.46) PPARAPPARGPPARDPTGER4
SCHEMBL5851098 0.90 PPARD (0.38) PPARAPPARGPPARDVDR
SCHEMBL5850733 0.89 PPARA (0.41) PPARAPPARGPPARDIDH1HDAC3
SCHEMBL5216633 0.89 LMNA (0.39) PPARAPPARGPPARDIDH1VDR
SCHEMBL6616727 0.85 PPARA (0.43) PPARAPPARGPPARDIDH1SCN10A
SCHEMBL5219009 0.84 LIPG (0.34) PPARAPPARGPPARDIDH1VDR
SCHEMBL5217765 0.83 PPARD (0.48) PPARAPPARGPPARDVDR
SCHEMBL5219143 0.83 PPARD (0.54) PPARAPPARGPPARD
SCHEMBL5221643 0.83 PPARD (0.48) PPARAPPARGPPARDVDR
SCHEMBL5217760 0.83 PPARD (0.48) PPARAPPARGPPARDVDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153878-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-12-26 US disclosed
US-20050107449-A1 Peroxisome proliferator activated receptor modulators ELILILLY AND COMPANY 2005-05-19 US disclosed
EP-1480640-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-01 EP disclosed
WO-2003072100-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 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 (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-20050107449-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARA 2/4885PPARG 1/4885PPARD 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.