SCHEMBL5751133

SCHEMBL5751133

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KLK5 Q9Y337 2/20 0.40
CTSK P43235 4/20 0.37
CTSS P25774 3/20 0.37
CETP P11597 9/20 0.37
ATM Q13315 1/20 0.36
CTSB P07858 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
CTSL P07711 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL5751180 0.90 CTSS (0.43) KLK5CTSKCTSSCETPCTSB
SCHEMBL5752754 0.88 KLK5 (0.42) KLK5CTSKCTSSCETPATM
SCHEMBL5751942 0.84 KLK5 (0.39) KLK5CTSKCTSSCETPCTSB
SCHEMBL5750069 0.79 CETP (0.41) CETPLMNAPOLB
SCHEMBL5752574 0.76 KLK1 (0.44) CETP
SCHEMBL5755604 0.76 KLK5 (0.44) KLK5CTSKCTSSATMCTSB
SCHEMBL5749425 0.76 UGCG (0.34) CETPMAPTHTT
SCHEMBL5752054 0.75 CTSS (0.44) KLK5CTSKCTSSATMCTSB
SCHEMBL5751982 0.74 UGCG (0.33) CETP
SCHEMBL7123267 0.72 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 KLK5 3906/4885CTSK 4401/4885CTSS 3800/4885

“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.