SCHEMBL5653695

SCHEMBL5653695

CCOC(=O)CCCCCNC(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.61
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TPSAB1 Q15661 1/20 0.50
TPSD1 Q9BZJ3 1/20 0.50
TPSG1 Q9NRR2 1/20 0.50
EPHX2 P34913 2/20 0.49
ALDH1A1 P00352 1/20 0.48
NAMPT P43490 1/20 0.47
CYP3A4 P08684 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL7158127 1.00 TDP1 (0.61) TDP1MAOAMAOBCA12CA1
SCHEMBL29256392 1.00 TDP1 (0.61) TDP1MAOAMAOBCA12CA1
SCHEMBL25095054 0.98 TDP1 (0.58) TDP1MAOAMAOBCA12CA1
SCHEMBL20711494 0.94 MAOA (0.56) TDP1MAOAMAOBCA12CA1
SCHEMBL572949 0.94 TDP1 (0.56) TDP1MAOAMAOBCA12CA1
SCHEMBL25827510 0.93 GAA (0.54) TDP1MAOAMAOBCA12CA1
SCHEMBL17244802 0.92 TDP1 (0.55) TDP1MAOAMAOBCA12CA1
SCHEMBL12188007 0.91 MAOA (0.52) TDP1MAOAMAOBCA12CA1
SCHEMBL17286147 0.90 CA12 (0.51) TDP1MAOAMAOBCA12CA1
SCHEMBL9555158 0.90 MAOA (0.57) TDP1MAOAMAOBCA12CA1

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 TDP1 4423/4885MAOA 866/4885MAOB 540/4885

“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.