SCHEMBL5587929

SCHEMBL5587929

CCCOC1=C(C(C)C)C(=O)C(=O)C(C(C)C)=C1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.34
CDC25B P30305 1/20 0.34
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 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
SCHEMBL5589654 0.92 CDC25A (0.33) CDC25ACDC25BCA12CA1CA2
SCHEMBL5590169 0.86 CDC25B (0.36) CDC25ACDC25B
SCHEMBL5589836 0.72 PTPN1 (0.33) CDC25ACDC25BCA12CA1CA2
SCHEMBL5590134 0.66 CDC25A (0.42) CDC25ACDC25B
SCHEMBL5590042 0.66 PTPN1 (0.41) CDC25ACDC25BCA12CA1CA2
SCHEMBL5590497 0.65 CDC25A (0.41) CDC25ACDC25B
SCHEMBL5588258 0.65 CDC25A (0.41) CDC25ACDC25B
SCHEMBL5590391 0.65 CDC25A (0.41) CDC25ACDC25B
SCHEMBL5590269 0.64 CDC25B (0.37) CDC25ACDC25B
SCHEMBL5587315 0.62 CA12 (0.38) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 CDC25A 1871/4885CDC25B 2427/4885CA12 2871/4885

“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.