SCHEMBL5653366

SCHEMBL5653366

O=C(O)CCCCCNC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.69
FOLH1 Q04609 4/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
HTT P42858 1/20 0.57
SIRT5 Q9NXA8 1/20 0.53
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
SIRT2 Q8IXJ6 2/20 0.52
SIRT1 Q96EB6 2/20 0.52
SIRT3 Q9NTG7 2/20 0.52
CPB1 P15086 1/20 0.51
CPB2 Q96IY4 1/20 0.51

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
SCHEMBL5653457 0.95 PTGER4 (0.73) PTGER4FOLH1CA1CA2HTT
SCHEMBL5656118 0.92 PTGER4 (0.59) PTGER4FOLH1CA1CA2MMP2
SCHEMBL5657140 0.89 PTGER4 (0.73) PTGER4FOLH1CA1CA2HTT
SCHEMBL27656055 0.89 PTGER4 (0.73) PTGER4FOLH1CA1CA2HTT
SCHEMBL5653166 0.86 PTGER4 (0.62) PTGER4FOLH1CA1CA2SIRT2
SCHEMBL23574915 0.86 PTGER4 (0.70) PTGER4FOLH1HTTSIRT5SIRT2
SCHEMBL22750161 0.86 PTGER4 (0.70) PTGER4FOLH1HTTSIRT5SIRT2
SCHEMBL5656785 0.84 PTGER4 (0.64) PTGER4FOLH1CA1CA2HTT
SCHEMBL5653495 0.83 MMP9 (0.74) PTGER4FOLH1CA1CA2HTT
SCHEMBL5651834 0.82 PTGER4 (1.00) PTGER4FOLH1HTTSIRT5SIRT2

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 1/4885FOLH1 2951/4885CA1 3110/4885

“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.