SCHEMBL5656851

SCHEMBL5656851

O=C(NCCCC(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
HTT P42858 1/20 0.51
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
FOLH1 Q04609 3/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
SLC1A3 P43003 1/20 0.47
SLC1A1 P43005 1/20 0.47
TGM2 P21980 1/20 0.46
KEAP1 Q14145 2/20 0.46
NFE2L2 Q16236 2/20 0.46
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
DPP8 Q6V1X1 1/20 0.44
DPP7 Q9UHL4 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
SCHEMBL29552624 0.88 KMT2A (0.71) KMT2AHDAC1HDAC2
SCHEMBL28730479 0.88 KMT2A (0.71) KMT2AHDAC1HDAC2
SCHEMBL4785263 0.87 KMT2A (0.70) KMT2AHTTHDAC1HDAC2LMNA
SCHEMBL23574786 0.86 FOLH1 (0.58) KMT2AHDAC1HDAC2FOLH1MMP2
SCHEMBL29400684 0.86 FOLH1 (0.58) KMT2AHDAC1HDAC2FOLH1MMP2
SCHEMBL23574788 0.86 FOLH1 (0.58) KMT2AHDAC1HDAC2FOLH1MMP2
SCHEMBL119447 0.86 FOLH1 (0.58) KMT2AHDAC1HDAC2FOLH1MMP2
SCHEMBL120774 0.86 FOLH1 (0.58) KMT2AHDAC1HDAC2FOLH1MMP2
SCHEMBL178815 0.83 FOLH1 (0.62) KMT2AHDAC1HDAC2FOLH1TGM2
SCHEMBL8823890 0.83 FOLH1 (0.62) KMT2AHDAC1HDAC2FOLH1TGM2

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 disclosed
CN-1898227-A As prostaglandin E2Ornithine derivatives as agonists or antagonists ASTELLAS PHARMA INC (JP) 2007-01-17 CN 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 KMT2A 1128/4885HTT 4290/4885HDAC1 1416/4885

“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.