SCHEMBL4575686

SCHEMBL4575686

Cc1cccc(-c2nc(N(CCc3ccc(OC(C)(C)C(=O)O)cc3)Cc3ccc(-c4noc(C5CC5)n4)cc3)no2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.42
PPARG P37231 7/20 0.42
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
GRM5 P41594 8/20 0.39
PPARD Q03181 1/20 0.39
FABP1 P07148 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL4598247 0.93 PPARA (0.43) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4575133 0.92 FABP1 (0.40) PPARAPPARGGRM5PPARDFABP1
SCHEMBL4575126 0.92 TUBB4A (0.41) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4575447 0.91 FFAR1 (0.43) PPARAPPARGPPARDNR1H4LMNA
SCHEMBL4575966 0.90 FABP1 (0.40) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4576160 0.89 PPARA (0.44) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4576216 0.89 MEN1 (0.41) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4574848 0.89 LMNA (0.43) PPARAPPARGGRM5PPARDALDH1A1
SCHEMBL4575329 0.88 PPARA (0.40) PPARAPPARGPPARDFABP1NR1H4
SCHEMBL4575732 0.88 PPARA (0.43) PPARAPPARGPPARDFABP1NR1H4

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 2/4885PPARG 1/4885CASP3 2001/4885

“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.