SCHEMBL5753040

SCHEMBL5753040

O=C(O)C(Cc1cccc(OC(F)(F)C(F)F)c1)C(O)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 4/20 0.44
ADRB1 P08588 2/20 0.44
CETP P11597 14/20 0.42
CNR1 P21554 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL5751829 0.88 CETP (0.49) CETPPPARGPPARA
SCHEMBL5752777 0.85 CETP (0.53) CETP
SCHEMBL5748762 0.85 CETP (0.46) CETPPPARGPPARA
SCHEMBL5752446 0.84 CETP (0.50) CETPPPARGPPARA
SCHEMBL5752336 0.84 CETP (0.41) CETP
SCHEMBL5751454 0.84 CETP (0.39) CETP
SCHEMBL5750415 0.84 CETP (0.44) CETP
SCHEMBL5752367 0.82 CETP (0.40) CETP
SCHEMBL5750046 0.81 CETP (0.39) CETPCNR1
SCHEMBL5752742 0.81 CETP (0.51) CETPPPARGPPARA

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 ADRB3 85/4885ADRB1 57/4885CETP 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.