SCHEMBL4349003

SCHEMBL4349003

C=CCOC(=O)C1(CCOC(C)=O)CCCC1=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL10798085 0.83 TSHR (0.42) ALDH1A1
SCHEMBL4349604 0.82 CYP2C19 (0.34) ALDH1A1
SCHEMBL8980371 0.81 CYP3A4 (0.33) ALDH1A1
SCHEMBL10427583 0.80
SCHEMBL18101495 0.79 TSHR (0.33) ALDH1A1
SCHEMBL10954179 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL10954184 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8828061 0.76 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11468671 0.75 LMNA (0.39) ALDH1A1
SCHEMBL25302536 0.75 CYP2C19 (0.37) ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524978-B2 2-oxabicyclo[3.3.0]octane compounds, process for producing the same, optical resolver, method of separating diastereomer mixture, and method of optically resolving alcohol ZEON CORPORATION (JP) 2009-04-28 US disclosed
US-7524978-B2 2-oxabicyclo[3.3.0]octane compounds, process for producing the same, optical resolver, method of separating diastereomer mixture, and method of optically resolving alcohol ZEON CORPORATION (JP) 2009-04-28 US disclosed
US-20060205960-A1 2-Oxabicyclo[3.3.0]octane compounds, process for producing the same, optical resolver, method of separating diastereomer mixture, and method of optically resolving alcohol ZEON CORPORATION (JP) 2006-09-14 US disclosed
EP-1535917-A1 2-OXABICYCLO 3.3.0 OCTANE COMPOUNDS, PROCESS FOR PRODUCING THE SAME, OPTICAL RESOLVER, METHOD OF SEPARATING DIASTEREOMER MIXTURE, AND METHOD OF OPTICALLY RESOLVING ALCOHOL Zeon Corporation (JP) 2005-06-01 EP 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-20060205960-A1 2-Oxabicyclo[3.3.0]octane compounds, process for producing the same, optical resolver, method of separating diastereomer mixture, and method of optically resolving alcohol OXER1, OR10J3, ADH1A ALDH1A1 78/4885

“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.