SCHEMBL5753587

SCHEMBL5753587

CCOC(=O)C(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.53
EPHX2 P34913 5/20 0.53
PPARA Q07869 2/20 0.50
MDM2 Q00987 4/20 0.47
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
UTS2R Q9UKP6 2/20 0.42
FFAR1 O14842 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GSK3B P49841 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
P2RX3 P56373 1/20 0.41
KCNH2 Q12809 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41

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
SCHEMBL5751165 0.89 PPARG (0.54) PPARGEPHX2PPARAMDM2GSK3B
SCHEMBL5751205 0.89 PPARG (0.54) PPARGEPHX2PPARAMDM2GSK3B
SCHEMBL5752412 0.88 PPARG (0.52) PPARGEPHX2PPARAMDM2
SCHEMBL5752947 0.87 EPHX2 (0.52) PPARGEPHX2PPARAFFAR1
SCHEMBL5750614 0.86 PPARG (0.51) PPARGEPHX2PPARAGSK3B
SCHEMBL5750586 0.86 PPARG (0.51) PPARGEPHX2PPARAMDM2
SCHEMBL5752346 0.85 GRM4 (0.51) PPARGEPHX2MDM2FFAR1
SCHEMBL27686858 0.84 PPARG (0.57) PPARGEPHX2PPARAFFAR1
SCHEMBL5753961 0.84 MAPK14 (0.55) PPARGEPHX2PPARAFFAR1
SCHEMBL5750773 0.81 PPARG (0.48) PPARGEPHX2PPARAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6982348-B2 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-03 US disclosed
US-20040127574-A1 Aminoethanol derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-07-01 US disclosed
EP-1362846-A1 AMINOETHANOL DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-11-19 EP 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-20040127574-A1 Aminoethanol derivatives CETP, LCAT, MTTP PPARG 905/4885EPHX2 1434/4885PPARA 708/4885

“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.