SCHEMBL10158716

SCHEMBL10158716

COCC(COC(=O)OCC(C)=O)OC(=O)OCCCCO

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.31
ACHE P22303 6/20 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
SCHEMBL10158713 0.84 ALDH1A1 (0.41)
SCHEMBL9289842 0.81 ALDH1A1 (0.33) AKT1
SCHEMBL10158740 0.80 ALDH1A1 (0.48)
SCHEMBL10158702 0.78 ALDH1A1 (0.37)
SCHEMBL10158715 0.74 ALDH1A1 (0.34)
SCHEMBL10158718 0.74 ALDH1A1 (0.48)
SCHEMBL10158719 0.73 TLR2 (0.40) AKT1
SCHEMBL10660161 0.72 ACHE (0.39) ACHE
SCHEMBL6379171 0.72 ACHE (0.39) ACHE
SCHEMBL6383317 0.72 ACHE (0.39) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130195954-A1 FILMS AND PARTICLES THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2013-08-01 US disclosed
US-8338492-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-12-25 US disclosed
US-8334324-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-12-18 US disclosed
US-20120107365-A1 FILMS AND PARTICLES THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2012-05-03 US disclosed
US-20110152305-A1 FILMS AND PARTICLES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2011-06-23 US disclosed
US-7671095-B2 Films and particles THE TRUSTEES OF THE BOSTON UNIVERSITY (US) 2010-03-02 US disclosed
US-20080075718-A1 Films and Particles THE TRUSTEES OF THE BOSTON UNIVERSITY 2008-03-27 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 (4 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-20110152305-A1 FILMS AND PARTICLES APOB, PGF, ACTB AKT1 3443/4885ACHE 2873/4885
US-20130195954-A1 FILMS AND PARTICLES APOB, PGF, ACTB AKT1 3443/4885ACHE 2873/4885
US-20080075718-A1 Films and Particles APOB, PGF, ACTB AKT1 3443/4885ACHE 2873/4885
US-20120107365-A1 FILMS AND PARTICLES APOB, PGF, ACTB AKT1 3443/4885ACHE 2873/4885

“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.