SCHEMBL5751180

SCHEMBL5751180

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

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.43
CTSK P43235 4/20 0.43
KLK5 Q9Y337 2/20 0.41
CETP P11597 9/20 0.41
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CTSB P07858 2/20 0.38
BACE1 P56817 1/20 0.37
CTSL P07711 1/20 0.37
CACNA1B Q00975 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
SCHEMBL5751133 0.90 KLK5 (0.40) CTSSCTSKKLK5CETPLMNA
SCHEMBL5752754 0.90 KLK5 (0.42) CTSSCTSKKLK5CETPLMNA
SCHEMBL5750069 0.89 CETP (0.41) CETPLMNAPOLBBACE1
SCHEMBL5751942 0.87 KLK5 (0.39) CTSSCTSKKLK5CETPLMNA
SCHEMBL5752574 0.86 KLK1 (0.44) CETP
SCHEMBL5755604 0.86 KLK5 (0.44) CTSSCTSKKLK5LMNACTSB
SCHEMBL5752054 0.85 CTSS (0.44) CTSSCTSKKLK5LMNACTSB
SCHEMBL5749779 0.80 CETP (0.40) CETPLMNAPOLBBACE1
SCHEMBL1900658 0.79 CETP (0.39) CETPLMNAPOLBBACE1
SCHEMBL5754542 0.79 CETP (0.39) CETPLMNAPOLBBACE1

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 CTSS 3800/4885CTSK 4401/4885KLK5 3906/4885

“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.