SCHEMBL5651805

SCHEMBL5651805

Cc1cccn2cc(C(=O)N[C@@H](CCCNC(=O)OCc3ccccc3)C(=O)Nc3ccccc3CCC(=O)O)nc12

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.45
SIRT5 Q9NXA8 5/20 0.45
FOLH1 Q04609 2/20 0.42
SIRT1 Q96EB6 2/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
HTT P42858 1/20 0.40
HDAC1 Q13547 1/20 0.39

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
SCHEMBL5654472 0.94 PTGER4 (0.41) PTGER4SIRT5FOLH1SIRT1SIRT2
SCHEMBL5652920 0.85 SIRT5 (0.49) PTGER4SIRT5FOLH1SIRT1SIRT2
SCHEMBL5655465 0.81 PTGER4 (0.52) PTGER4SIRT5FOLH1HTTHDAC1
SCHEMBL5654551 0.80 HDAC1 (0.47) PTGER4SIRT5FOLH1HDAC1
SCHEMBL5652253 0.80 HDAC1 (0.48) PTGER4SIRT5FOLH1HDAC1
SCHEMBL5739335 0.79 PTGER4 (0.44) PTGER4SIRT5FOLH1SIRT1SIRT2
SCHEMBL5655295 0.78 PTGER4 (0.54) PTGER4SIRT5FOLH1HTT
SCHEMBL27676042 0.78 PTGER4 (0.54) PTGER4SIRT5FOLH1HTT
SCHEMBL5654868 0.78 HDAC1 (0.46) PTGER4SIRT5FOLH1HDAC1
SCHEMBL5652878 0.78 SIRT5 (0.49) PTGER4SIRT5FOLH1SIRT1HDAC1

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-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists ASTELLAS PHARMA INC. (JP) 2007-06-21 US claimed
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.