SCHEMBL2003493

SCHEMBL2003493

C=CC[Si](C)(C)c1ccccc1CO

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
PDXK O00764 2/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
MAOB P27338 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL2007121 0.78 APOBEC3G (0.41) APOBEC3GNR1H2NR1H3PDXKPDCD1
SCHEMBL10941267 0.76 NR1H2 (0.38) NR1H2NR1H3ALDH1A1
SCHEMBL10913604 0.76 ALDH1A1 (0.39) NR1H2NR1H3ALDH1A1
SCHEMBL9206225 0.74 APOBEC3G (0.48) APOBEC3GPDCD1CD274MAOB
SCHEMBL18796002 0.74 NR1H2 (0.37) NR1H2NR1H3ALDH1A1
SCHEMBL3700317 0.74 NR1H2 (0.37) NR1H2NR1H3ALDH1A1
SCHEMBL12572225 0.70 APOBEC3G (0.41) APOBEC3GPDCD1CD274MAOB
SCHEMBL556905 0.70 LIPG (0.39) APOBEC3GNR1H2NR1H3
Propene SCHEMBL6298688 0.69 APOBEC3G (0.46) APOBEC3GPDXKPDCD1CD274GABRA1
SCHEMBL2006118 0.69 APOBEC3G (0.39) APOBEC3GPDCD1CD274

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-7960571-B2 Silicon-based cross-coupling reagent and production method of organic compound using the same KYOTO UNIVERSITY (JP) 2011-06-14 US disclosed
US-20090069577-A1 Silicon-Based Cross-Coupling Reagent and Production Method of Organic Compound Using the Same KYOTO UNIVERSITY (JP) 2009-03-12 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-20090069577-A1 Silicon-Based Cross-Coupling Reagent and Production Method of Organic Compound Using the Same DNMT1, TET3, CTCF APOBEC3G 3259/4885NR1H2 3400/4885NR1H3 2771/4885

“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.