SCHEMBL390815

SCHEMBL390815

CCC(C)(C)C(=O)OCOC(=O)Cl

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
HMGCR P04035 1/20 0.31

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
SCHEMBL5021627 0.89 CYP4F2 (0.41) CYP4F2CYP4A11HMGCR
SCHEMBL2625589 0.81 ALDH1A1 (0.42) CYP4F2CYP4A11HMGCR
SCHEMBL11964190 0.81 NAAA (0.38) CYP4F2CYP4A11HMGCR
SCHEMBL390512 0.80 PRKCA (0.39) CYP4F2CYP4A11
SCHEMBL7878408 0.80 DGAT1 (0.33)
SCHEMBL25667376 0.79 CYP4F2 (0.35) CYP4F2CYP4A11HMGCR
SCHEMBL47526 0.78 CYP4F2 (0.37) CYP4F2CYP4A11HMGCR
SCHEMBL2625610 0.78 ALDH1A1 (0.48) CYP4F2CYP4A11HMGCR
SCHEMBL13302408 0.77 CYP4F2 (0.36) CYP4F2CYP4A11HMGCR
SCHEMBL92362 0.77 CYP4F2 (0.40) CYP4F2CYP4A11HMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101590-B2 9-aminocarbonylsubstituted derivatives of glycylcyclines WYETH LLC (US) 2012-01-24 US disclosed
EP-1919879-A1 9-AMINOCARBONYLSUBSTITUTED DERIVATIVES OF GLYCYLCYCLINES Wyeth a Corporation of the State of Delaware (US) 2008-05-14 EP disclosed
WO-2007027599-A1 9-AMINOCARBONYLSUBSTITUTED DERIVATIVES OF GLYCYLCYCLINES WYETH (US) 2007-03-08 WO disclosed
US-20070049564-A1 9-Aminocarbonylsubstituted derivatives of glycylcyclines WYETH (US) 2007-03-01 US disclosed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO 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-20070049564-A1 9-Aminocarbonylsubstituted derivatives of glycylcyclines Q6ZSR9, GMPS, RPS10 CYP4F2 2856/4885CYP4A11 2960/4885HMGCR 3126/4885

“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.