SCHEMBL13663147

SCHEMBL13663147

CCCCN1C(=O)OCC[C@@H]1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CYP1A2 P05177 1/20 0.31
▸ DUT P33316 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ RIN1 Q13671 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ FKBP1A P62942 1/20 0.30

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
SCHEMBL4907581 0.87 TP53 (0.33) TP53GAADUTFKBP1A
SCHEMBL13871611 0.81 KDM4E (0.31) GAADUT
SCHEMBL4304524 0.80 FKBP1A (0.30) FKBP1A
SCHEMBL2211707 0.80 ALDH1A1 (0.39) GAA
SCHEMBL4300107 0.78 HRH1 (0.42) TP53CYP1A2
SCHEMBL4551977 0.78 HRH1 (0.42) TP53CYP1A2
SCHEMBL4106475 0.74 PTGER4 (0.34) —
SCHEMBL961203 0.73 DUT (0.33) DUTFKBP1A
SCHEMBL4301619 0.72 CYP4F2 (0.41) FKBP1A
SCHEMBL3679333 0.70 PDK2 (0.34) DUT

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-20090270395-A1 EP4 Receptor Agonist, Compositions and Methods Thereof MERCK & CO., INC. 2009-10-29 — — 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-20090270395-A1 EP4 Receptor Agonist, Compositions and Methods Thereof PTGER4, PTGER1, PTGER3 TP53 4631/4885GAA 3844/4885CYP1A2 1051/4885

“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.

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