SCHEMBL5655056

SCHEMBL5655056

O=C(O)CCc1ccccc1NC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.51
SIRT5 Q9NXA8 6/20 0.49
HTT P42858 1/20 0.49
MMP2 P08253 3/20 0.49
MMP9 P14780 3/20 0.49
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
MMP7 P09237 1/20 0.45
MMP13 P45452 1/20 0.45
ITGB3 P05106 1/20 0.45
ITGAV P06756 1/20 0.45
PTGER4 P35408 1/20 0.44

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
SCHEMBL5656235 0.92 MMP2 (0.47) FOLH1SIRT5HTTMMP2MMP9
SCHEMBL5653852 0.84 FOLH1 (0.46) FOLH1SIRT5HTTPTGER4
SCHEMBL5653432 0.82 SIRT5 (0.51) FOLH1SIRT5HTTPTGER4
SCHEMBL5654845 0.80 PTGER4 (0.50) FOLH1SIRT5HTTMMP2MMP9
SCHEMBL5654632 0.80 SIRT5 (0.51) FOLH1SIRT5HTTPTGER4
SCHEMBL5654083 0.80 CA1 (0.52) FOLH1SIRT5MMP2MMP9PTGER4
SCHEMBL5653545 0.79 SIRT5 (0.52) FOLH1SIRT5HTTPTGER4
SCHEMBL5655295 0.79 PTGER4 (0.54) FOLH1SIRT5HTTPTGER4
SCHEMBL27676042 0.79 PTGER4 (0.54) FOLH1SIRT5HTTPTGER4
SCHEMBL5654655 0.78 SIRT5 (0.49) FOLH1SIRT5HTTPTGER4

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 FOLH1 2951/4885SIRT5 1504/4885HTT 4290/4885

“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.