SCHEMBL5752574

SCHEMBL5752574

O=C(NC(Cc1cccc(OC(F)(F)C(F)F)c1)C(O)c1ccc(F)cc1)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KLK1 P06870 2/20 0.44
OPRK1 P41145 1/20 0.43
TP53 P04637 1/20 0.43
PLAU P00749 3/20 0.42
CETP P11597 3/20 0.41
MGLL Q99685 1/20 0.41
KLK8 O60259 2/20 0.40
F10 P00742 2/20 0.40
PLG P00747 2/20 0.40
KLK4 Q9Y5K2 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
F2 P00734 1/20 0.40
PLAT P00750 1/20 0.40
KLK2 P20151 1/20 0.40

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
SCHEMBL5750069 0.90 CETP (0.41) CETP
SCHEMBL5751180 0.86 CTSS (0.43) CETP
SCHEMBL5751446 0.81 CTSL (0.50) OPRK1PLAUMGLLTRPM8
SCHEMBL5754542 0.80 CETP (0.39) CETP
SCHEMBL1900660 0.80 CETP (0.39) CETP
SCHEMBL1900658 0.80 CETP (0.39) CETP
SCHEMBL5749779 0.79 CETP (0.40) CETP
SCHEMBL5748762 0.79 CETP (0.46) CETP
SCHEMBL5750976 0.78 CETP (0.38) CETP
SCHEMBL7123267 0.77 CETP (0.38) 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 KLK1 3578/4885OPRK1 2041/4885TP53 4608/4885

“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.