SCHEMBL4575664

SCHEMBL4575664

CC(C)(Oc1ccc(CCN(Cc2ccc(C(F)(F)F)cc2)c2noc(C3CCN(Cc4ccccc4)CC3)n2)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.49
PPARD Q03181 7/20 0.49
KCNH2 Q12809 1/20 0.44
SLC6A5 Q9Y345 1/20 0.42
SIGMAR1 Q99720 2/20 0.42
PPARG P37231 3/20 0.40
CHRM4 P08173 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
PIK3CA P42336 1/20 0.39
PRKAA2 P54646 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL4576195 0.93 PPARA (0.44) PPARAPPARDSLC6A5PPARGLMNA
SCHEMBL4574698 0.90 PPARA (0.46) PPARAPPARDPPARG
SCHEMBL4575268 0.89 PPARA (0.42) PPARAPPARDKCNH2PPARGLMNA
SCHEMBL4575130 0.89 BCL9 (0.43) PPARAPPARDKCNH2PPARG
SCHEMBL4575396 0.89 PPARA (0.45) PPARAPPARDPPARG
SCHEMBL4576178 0.89 PPARA (0.45) PPARAPPARDPPARG
SCHEMBL4575604 0.89 PPARA (0.42) PPARAPPARDKCNH2PPARG
SCHEMBL4575862 0.88 PPARA (0.41) PPARAPPARDKCNH2PPARGLMNA
SCHEMBL4576147 0.88 PPARA (0.44) PPARAPPARDPPARG
SCHEMBL4575955 0.88 PPARA (0.44) PPARAPPARDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD PPARA 2/4885PPARD 3/4885KCNH2 3961/4885

“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.