SCHEMBL5653554

SCHEMBL5653554

COC(=O)CCc1ccccc1NC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 1/20 0.46
KCNA5 P22460 2/20 0.46
PTGER4 P35408 4/20 0.44
SIRT1 Q96EB6 4/20 0.44
SIRT2 Q8IXJ6 3/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
FOLH1 Q04609 1/20 0.43

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
SCHEMBL5653432 0.93 SIRT5 (0.51) SIRT5KCNA5PTGER4HDAC1HDAC2
SCHEMBL5654083 0.89 CA1 (0.52) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5740585 0.85 CA1 (0.50) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5655221 0.85 FAP (0.47) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5653306 0.85 SIRT5 (0.42) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5653258 0.85 KLK7 (0.51) SIRT5SIRT1SIRT2
SCHEMBL5653753 0.84 NR1H4 (0.49) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5654264 0.84 CA1 (0.47) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5739335 0.84 PTGER4 (0.44) SIRT5PTGER4SIRT1SIRT2CA1
SCHEMBL5654879 0.83 HDAC1 (0.49) SIRT5PTGER4SIRT1SIRT2HDAC1

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-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists ASTELLAS PHARMA INC. (JP) 2007-06-21 US disclosed
EP-1697337-A2 ORNITHINE DERIVATIVES AS PROSTAGLANDIN-E2-AGONISTS OR ANTAGONISTS Astellas Pharma Inc. (JP) 2006-09-06 EP disclosed
WO-2005061475-A2 ORNITHINE DERIVATIVES AS PROSTAGLANDIN E2 AGONISTS OR ANTAGONISTS ASTELLAS PHARMA INC. (JP) 2005-07-07 WO 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 SIRT5 1504/4885KCNA5 1149/4885PTGER4 1/4885

“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.