SCHEMBL5082215

SCHEMBL5082215

C[Si](C)(C)OCC1(CO[Si](C)(C)C)c2ccccc2-c2ccc(F)cc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.44
KCNQ2 O43526 2/20 0.33
ADRA1D P25100 2/20 0.33
ADRA1A P35348 2/20 0.33
ADRA1B P35368 2/20 0.33
KCNH2 Q12809 2/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
GPR3 P46089 1/20 0.33
PBRM1 Q86U86 1/20 0.32
HSD11B1 P28845 1/20 0.32
AKR1A1 P14550 1/20 0.32
AKR1B1 P15121 1/20 0.32

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
SCHEMBL5081787 0.87 PDK2 (0.41) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5940614 0.86 PDK2 (0.40) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5082289 0.86 PDK2 (0.43) PDK2
SCHEMBL5082343 0.86 APEX1 (0.39) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5082322 0.86 PDK2 (0.42) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5085385 0.85 PDK2 (0.40) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5084662 0.84 PDK2 (0.39) PDK2KCNQ2ADRA1DADRA1AADRA1B
SCHEMBL5940616 0.83 PDK2 (0.41) PDK2GPR3
SCHEMBL5085278 0.83 PDK2 (0.38) PDK2HSD11B1
SCHEMBL5940617 0.83 PDK2 (0.38) PDK2ALOX15HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US claimed
US-6822109-B2 TRIHYDROCARBYLSILYLATION; ADDITION POLYMERIZATION OF OLEFINS CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2004-11-23 US claimed
US-7323431-B2 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-01-29 US disclosed
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US disclosed
US-6822109-B2 TRIHYDROCARBYLSILYLATION; ADDITION POLYMERIZATION OF OLEFINS CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2004-11-23 US disclosed
US-20040106814-A1 Silicon ether compound, a method for the preparation thereof and use thereof BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2004-06-03 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-20040106814-A1 Silicon ether compound, a method for the preparation thereof and use thereof SIK1, CDK20, SGMS1 PDK2 3730/4885KCNQ2 2637/4885ADRA1D 2399/4885

“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.