SCHEMBL5656160

SCHEMBL5656160

Cn1c(C(=O)N[C@@H](CCCNC(=O)OCc2ccoc2)C(=O)Nc2ccccc2CCC(=O)O)cc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.45
SIRT5 Q9NXA8 5/20 0.40
FOLH1 Q04609 2/20 0.39
HDAC1 Q13547 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC2 Q92769 1/20 0.38
CTSS P25774 2/20 0.38
CTSL P07711 1/20 0.38
SIRT1 Q96EB6 1/20 0.37
TACR2 P21452 1/20 0.36

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
SCHEMBL5654016 0.94 PTGER4 (0.40) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5654596 0.92 PTGER4 (0.51) PTGER4SIRT5FOLH1CTSSCTSL
SCHEMBL5655066 0.90 PTGER4 (0.47) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5748958 0.89 PTGER4 (0.46) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5653195 0.88 PTGER4 (0.46) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5655253 0.88 PTGER4 (0.47) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5654303 0.88 PTGER4 (0.42) PTGER4SIRT5FOLH1HDAC1HDAC3
SCHEMBL5653800 0.87 PTGER4 (0.46) PTGER4SIRT5HDAC1HDAC3HDAC2
SCHEMBL5653374 0.84 PTGER4 (0.41) PTGER4SIRT5HDAC1HDAC3HDAC2
SCHEMBL5653738 0.84 CTSS (0.47) PTGER4SIRT5CTSSCTSLSIRT1

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 PTGER4 1/4885SIRT5 1504/4885FOLH1 2951/4885

“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.