SCHEMBL2290612

SCHEMBL2290612

C=C[Si](O)(CCC)Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
TP53 P04637 1/20 0.35
EPHX2 P34913 3/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HPGD P15428 2/20 0.34
ALOX12 P18054 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALPL P05186 1/20 0.34
ALDH1A1 P00352 1/20 0.33
FAAH O00519 1/20 0.33
RIPK1 Q13546 1/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 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
SCHEMBL2285686 0.90 EPHX2 (0.36) TP53EPHX2HPGDSMN1; SMN2FAAH
SCHEMBL2291514 0.85 TP53 (0.38) GAATP53CYP3A4CYP2C19ALDH1A1
SCHEMBL2295123 0.85 TSHR (0.39) GAATP53ALDH1A1
SCHEMBL2286929 0.76 GAA (0.37) GAATP53EPHX2CYP3A4CYP2C19
SCHEMBL15302220 0.75 TP53 (0.35) GAATP53CYP3A4CYP2C19ALDH1A1
SCHEMBL15302554 0.75 TP53 (0.35) GAATP53
SCHEMBL15302831 0.75 TP53 (0.35) GAATP53L3MBTL1
SCHEMBL15302150 0.75 TP53 (0.42) GAATP53EPHX2CYP3A4CYP2C19
SCHEMBL2288387 0.73 TSHR (0.32)
SCHEMBL2294978 0.73 NR1H2 (0.38) GAATP53CYP3A4CYP2C19ALDH1A1

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-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
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 GAA 3073/4885TP53 3501/4885EPHX2 2751/4885

“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.