SCHEMBL2690002

SCHEMBL2690002

CCOC(=O)CC(CC(=O)O)(OC(CC)[Si](OCC)(OCC)OCC)C(=O)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPID Q08752 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
ALDH1A1 P00352 5/20 0.35
RAB9A P51151 5/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 2/20 0.35
ADORA3 P0DMS8 1/20 0.34
MAPK1 P28482 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 2/20 0.33
STAT1 P42224 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL2689997 0.89 KMT2A (0.37) PPIDL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL2688491 0.82 MGAM (0.31) GAA
SCHEMBL4734515 0.74 ADORA3 (0.39) PPIDL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL28836748 0.70 ALDH1A1 (0.49) PPIDL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL28675001 0.69 ALDH1A1 (0.47) PPIDL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL2688476 0.69 USP2 (0.33) LMNA
SCHEMBL28113526 0.69 ALDH1A1 (0.50) PPIDL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL28665145 0.68 ALDH1A1 (0.48) PPIDL3MBTL1ALDH1A1KMT2AMAPK1
SCHEMBL3282967 0.67 ALDH1A1 (0.54) L3MBTL1ALDH1A1KMT2AMAPK1SLC6A2
SCHEMBL242004 0.67 ALDH1A1 (0.56) L3MBTL1ALDH1A1KMT2AMAPK1SLC6A2

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 4 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
EP-1915385-A1 CHELATING SILICON-BASED POLYMERS McMaster University (CA) 2008-04-30 EP disclosed
WO-2007014471-A1 CHELATING SILICON-BASED POLYMERS MCMASTER UNIVERSITY (CA) 2007-02-08 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-20090118456-A1 CHELATING SILICON-BASED POLYMERS SRM, SMURF1, SLC39A14 PPID 355/4885L3MBTL1 3625/4885SIRT2 201/4885

“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.