SCHEMBL4575347

SCHEMBL4575347

CCOC(=O)C(C)(C)Oc1ccc(CCN(Cc2ccc(C(F)(F)F)cc2)c2ccc(N(S(C)(=O)=O)S(C)(=O)=O)cn2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.39
PPARA Q07869 9/20 0.37
PPARD Q03181 4/20 0.37
MAOB P27338 1/20 0.37
ABCB11 O95342 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
HTR2A P28223 1/20 0.37
PMP22 Q01453 1/20 0.37
PPARG P37231 4/20 0.37
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RORC P51449 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
SCHEMBL6637811 0.90 PPARA (0.47) PPARAPPARDPPARGMMP2MMP9
SCHEMBL4575563 0.87 MCHR1 (0.38) PPARAPPARDABCB11CYP1A2CYP3A4
SCHEMBL4575691 0.86 MAOB (0.44) PPARAPPARDMAOBABCB11CYP1A2
SCHEMBL4575784 0.86 PPARA (0.40) GRM2PPARAPPARDMAOBABCB11
SCHEMBL4575509 0.86 PPARA (0.40) GRM2PPARAPPARDMAOBABCB11
SCHEMBL4574832 0.85 FBP1 (0.40) PPARAPPARDMAOBABCB11CYP1A2
SCHEMBL4575411 0.85 FBP1 (0.39) GRM2PPARAPPARDMAOBABCB11
SCHEMBL4575218 0.85 PPARA (0.39) GRM2PPARAPPARDMAOBABCB11
SCHEMBL4576065 0.84 MAOB (0.40) PPARAPPARDMAOBABCB11CYP1A2
SCHEMBL4574849 0.80 PPARA (0.42) GRM2PPARAPPARDABCB11CYP1A2

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-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 GRM2 1726/4885PPARA 2/4885PPARD 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.