SCHEMBL4615329

SCHEMBL4615329

CCC(NO)c1cc(F)cc(Oc2ccc(CCC(=O)OC)c(C)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.41
PPARD Q03181 9/20 0.41
PPARA Q07869 9/20 0.41
MMP1 P03956 1/20 0.35
CYP2D6 P10635 1/20 0.35
KCNH2 Q12809 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL4616253 0.88 PPARG (0.44) PPARGPPARDPPARAMMP1MEN1
SCHEMBL14289653 0.87 PPARG (0.40) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL14519911 0.87 PPARG (0.40) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL4614125 0.87 PPARG (0.40) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL4636383 0.85 PPARG (0.41) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL14289620 0.85 PPARG (0.41) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL4614651 0.85 PPARG (0.41) PPARGPPARDPPARAMEN1KMT2A
SCHEMBL4615074 0.81 MMP1 (0.37) PPARGPPARDPPARAMMP1MEN1
SCHEMBL4616960 0.81 MAOB (0.39) PPARGPPARDPPARAMMP1MEN1
SCHEMBL4527379 0.80 PPARG (0.39) PPARGPPARDPPARAMMP1MEN1

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
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
EP-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 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-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARG 1/4885PPARD 3/4885PPARA 2/4885

“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.