SCHEMBL5752824

SCHEMBL5752824

CS(=O)(=O)c1ccc(C(O)C(Cc2cccc(OC(F)(F)C(F)F)c2)C(=O)O)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 16/20 0.40
AKR1C3 P42330 2/20 0.37
AKR1C2 P52895 2/20 0.37
SCN9A Q15858 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSF Q9UBX1 1/20 0.37

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
SCHEMBL5748762 0.86 CETP (0.46) CETP
SCHEMBL5752538 0.86 CETP (0.40) CETP
SCHEMBL5752336 0.85 CETP (0.41) CETP
SCHEMBL5752446 0.85 CETP (0.50) CETP
SCHEMBL5749325 0.84 SLC7A5 (0.42) CETP
SCHEMBL5752742 0.83 CETP (0.51) CETP
SCHEMBL5751829 0.81 CETP (0.49) CETP
SCHEMBL5753040 0.81 ADRB3 (0.44) CETP
SCHEMBL5751452 0.80 CETP (0.40) CETP
SCHEMBL5751454 0.79 CETP (0.39) 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 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 CETP 1/4885AKR1C3 524/4885AKR1C2 516/4885

“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.