SCHEMBL4449133

SCHEMBL4449133

C=CCCCCOC(CC(=O)O)(CC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 1/20 0.44
MAPT P10636 1/20 0.44
LPAR3 Q9UBY5 2/20 0.40
LPAR2 Q9HBW0 1/20 0.40
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
SLC2A1 P11166 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
SCHEMBL13523682 0.81 ALDH1A1 (0.39) ALDH1A1
SCHEMBL4402455 0.77 HSPD1 (0.40) ALDH1A1
SCHEMBL3713421 0.76 CAMK2A (0.36) ALDH1A1
SCHEMBL5371980 0.76 ALDH1A1 (0.34) ALDH1A1
SCHEMBL8507314 0.75 HSPD1 (0.42) ALDH1A1
SCHEMBL9513981 0.75 HSPD1 (0.42) ALDH1A1
SCHEMBL3627972 0.75 MAPT (0.42) ABCC4MAPTLPAR3LPAR2ALDH1A1
SCHEMBL3223653 0.75 HSPD1 (0.42) ALDH1A1
SCHEMBL8505820 0.75 HSPD1 (0.42) ALDH1A1
SCHEMBL21068602 0.75 MAPT (0.42) ABCC4MAPTLPAR3LPAR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168741-B2 Chelating silicon-based polymers JOINT INTELLECTUAL PROPERTY POLICY OF MCMASTER UNIVERSITY (CA) 2012-05-01 US disclosed
US-20090118456-A1 CHELATING SILICON-BASED POLYMERS MCMASTER UNIVERSITY (CA) 2009-05-07 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-20090118456-A1 CHELATING SILICON-BASED POLYMERS SRM, SMURF1, SLC39A14 ABCC4 2000/4885MAPT 2415/4885LPAR3 3887/4885

“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.