SCHEMBL2293538

SCHEMBL2293538

C=CC[Si](O)(CCCC)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PCSK9 Q8NBP7 1/20 0.36
EGFR P00533 1/20 0.34
NAAA Q02083 1/20 0.32
AR P10275 1/20 0.32
PTGS2 P35354 1/20 0.32
HDAC3 O15379 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 2/20 0.31
HTT P42858 2/20 0.31
ALDH1A1 P00352 2/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
NR1I2 O75469 1/20 0.31
EPHX1 P07099 3/20 0.30
EPHX2 P34913 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL2291119 0.90 GAA (0.33) PCSK9ALDH1A1NR1H2NR1H3
SCHEMBL3482551 0.84 PCSK9 (0.39) PCSK9EGFRNAAAARPTGS2
SCHEMBL2292460 0.82 NR1H2 (0.33) TSHRALDH1A1NR1H2NR1H3
SCHEMBL15302725 0.82 ALDH1A1 (0.34) LMNATSHRHTTALDH1A1NR1H2
SCHEMBL273717 0.80 PCSK9 (0.37) PCSK9EGFRNAAAARPTGS2
SCHEMBL3481932 0.80 PCSK9 (0.37) PCSK9EGFRNAAAARPTGS2
SCHEMBL5077495 0.79 AR (0.37) PCSK9NAAAARPTGS2TSHR
SCHEMBL6965430 0.78 NAAA (0.41) PCSK9EGFRNAAAPTGS2HTT
SCHEMBL27827259 0.77 PCSK9 (0.35) PCSK9EGFRNAAAARPTGS2
SCHEMBL11780094 0.77 NAAA (0.43) EGFRNAAAHTTALDH1A1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268489-B2 Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery comprising the same LG CHEM, LTD. (KR) 2012-09-18 US claimed
US-20110206999-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY COMPRISING THE SAME LG CHEM, LTD. (KR) 2011-08-25 US claimed
US-8791221-B2 Addition-curable metallosiloxane compound DAICEL CORPORATION (JP) 2014-07-29 US disclosed
EP-2650319-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND Daicel Corporation (JP) 2013-10-16 EP disclosed
US-20130267653-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND DAICEL CORPORATION (JP) 2013-10-10 US disclosed
CN-103249762-A Addition-curable metallosiloxane compound DAICEL CORP 2013-08-14 CN disclosed
US-8268489-B2 Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery comprising the same LG CHEM, LTD. (KR) 2012-09-18 US disclosed
US-20110206999-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY COMPRISING THE SAME LG CHEM, LTD. (KR) 2011-08-25 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-20130267653-A1 ADDITION-CURABLE METALLOSILOXANE COMPOUND B2M, MSI2, MNS1 PCSK9 4133/4885EGFR 2718/4885NAAA 2244/4885

“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.