SCHEMBL4575260

SCHEMBL4575260

CC(C)(C)OC(=O)N1CCC(c2nc(N(CCc3ccc(OC(C)(C)C(=O)O)cc3)Cc3ccc(C(F)(F)F)cc3)no2)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.40
PPARD Q03181 9/20 0.40
PPARG P37231 4/20 0.40
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
P2RY14 Q15391 1/20 0.38
GPR119 Q8TDV5 3/20 0.38
HDAC4 P56524 1/20 0.37
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36

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
SCHEMBL4575594 0.94 PPARA (0.41) PPARAPPARDPPARG
SCHEMBL4575471 0.93 PPARA (0.42) PPARAPPARDPPARGGAASMN1; SMN2
SCHEMBL4575268 0.92 PPARA (0.42) PPARAPPARDPPARGGAASMN1; SMN2
SCHEMBL4575862 0.91 PPARA (0.41) PPARAPPARDPPARGGAASMN1; SMN2
SCHEMBL4575286 0.90 SCN9A (0.39) PPARAPPARDPPARGGAASMN1; SMN2
SCHEMBL4575130 0.90 BCL9 (0.43) PPARAPPARDPPARG
SCHEMBL4574698 0.90 PPARA (0.46) PPARAPPARDPPARG
SCHEMBL4575604 0.90 PPARA (0.42) PPARAPPARDPPARG
SCHEMBL4576195 0.90 PPARA (0.44) PPARAPPARDPPARGGAASMN1; SMN2
SCHEMBL4576178 0.89 PPARA (0.45) 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 3/4885PPARG 1/4885

“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.