SCHEMBL5753448

SCHEMBL5753448

CCOC(=O)C(Cc1cccc(SC(F)(F)F)c1)C(O)c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.37
RXFP1 Q9HBX9 2/20 0.37
PPARG P37231 3/20 0.35
PPARA Q07869 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
EPHX2 P34913 2/20 0.34
PPARD Q03181 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC4 P56524 1/20 0.34
MEF2D Q14814 1/20 0.34
SLC1A1 P43005 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
UBE2M P61081 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32

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
SCHEMBL5751725 0.86 SLC1A1 (0.44) CETPPPARGPPARAFFAR4PPARD
SCHEMBL5751324 0.80 MDM2 (0.44) RXFP1PPARGPPARAEPHX2L3MBTL1
SCHEMBL5750935 0.78 CETP (0.38) CETPPPARGFFAR4SLC1A1MAPK1
SCHEMBL5752376 0.77 PPARG (0.47) PPARGPPARAEPHX2
SCHEMBL7125123 0.74 SMN1; SMN2 (0.45) PPARGEPHX2L3MBTL1SMN1; SMN2MAPK1
SCHEMBL5750535 0.74 PPARG (0.34) PPARGFFAR4EPHX2KMT2A
SCHEMBL5754281 0.73 CYP4F2 (0.34) PPARGEPHX2L3MBTL1SMN1; SMN2
SCHEMBL5751555 0.72 CETP (0.37) CETPPPARGEPHX2MAPK1KMT2A
SCHEMBL5753449 0.72 CETP (0.36) CETPRXFP1PPARGPPARAFFAR4
SCHEMBL5752277 0.71 CETP (0.46) CETP

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 2 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

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 CETP 1/4885RXFP1 1700/4885PPARG 905/4885

“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.