SCHEMBL15726451

SCHEMBL15726451

CC(C)P(=O)(O)OCCC(O)CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
THRB P10828 1/20 0.34
LAP3 P28838 3/20 0.33
LPAR5 Q9H1C0 1/20 0.30
LMNA P02545 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
SCHEMBL15726435 0.81 PPARD (0.37) SMN1; SMN2LAP3LPAR5
SCHEMBL14417988 0.80 SMN1; SMN2 (0.45) SMN1; SMN2LAP3LPAR5LMNA
SCHEMBL15729176 0.80 SAT1 (0.38) SMN1; SMN2THRBLPAR5LMNA
SCHEMBL10535577 0.79 THRB (0.40) SMN1; SMN2THRBLPAR5LMNA
SCHEMBL17211914 0.74 LPAR3 (0.41) LAP3
SCHEMBL12212674 0.73 CYP3A4 (0.40) LAP3LPAR5
SCHEMBL12212668 0.73 LPAR3 (0.50) LAP3LPAR5
SCHEMBL12212661 0.73 CYP3A4 (0.40) LAP3LPAR5
SCHEMBL12212669 0.73 LPAR3 (0.50) LAP3LPAR5
SCHEMBL17211777 0.73 CYP3A4 (0.40) LAP3LPAR5

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-20140142044-A1 PEPTIDE MIMETIC LIGANDS OF POLO-LIKE KINASE 1 POLO BOX DOMAIN AND METHODS OF USE The United States of America, as represented by the Secretary, Department of Health & Human Servic (US) 2014-05-22 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-20140142044-A1 PEPTIDE MIMETIC LIGANDS OF POLO-LIKE KINASE 1 POLO BOX DOMAIN AND METHODS OF USE PLK1, PLK4, PLK3 SMN1; SMN2 4608/4885THRB 1076/4885LAP3 478/4885

“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.