SCHEMBL5653258

SCHEMBL5653258

COC(=O)CCc1ccccc1NC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 2/20 0.51
KLK5 Q9Y337 2/20 0.51
MAPT P10636 1/20 0.50
SIRT5 Q9NXA8 2/20 0.49
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
ITGB3 P05106 1/20 0.48
ITGA2B P08514 1/20 0.48
SIRT1 Q96EB6 7/20 0.47
SIRT2 Q8IXJ6 7/20 0.47
SIRT3 Q9NTG7 3/20 0.46

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
SCHEMBL5655281 0.94 KLK7 (0.46) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5653518 0.94 MAPT (0.46) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5653289 0.94 KLK7 (0.45) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5655104 0.92 KLK7 (0.44) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5655273 0.92 CTSK (0.43) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5654714 0.92 KLK7 (0.45) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5655177 0.92 MAPT (0.44) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5653286 0.91 KLK7 (0.43) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5655245 0.91 KLK7 (0.44) KLK7KLK5MAPTSIRT5CTSS
SCHEMBL5653112 0.90 KEAP1 (0.43) KLK7KLK5MAPTSIRT5CTSS

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists ASTELLAS PHARMA INC. (JP) 2007-06-21 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-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists PTGER4, OXER1, RXFP4 KLK7 1738/4885KLK5 1984/4885MAPT 4848/4885

“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.