SCHEMBL5078647

SCHEMBL5078647

CC[Si](C)(C)OCC1(CO[Si](C)(C)CC)c2ccccc2-c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
ITGA4 P13612 1/20 0.35
KCNQ2 O43526 5/20 0.33
CYP2C9 P11712 2/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PGR P06401 3/20 0.32
PDK2 Q15119 5/20 0.31
CYP2D6 P10635 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 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
SCHEMBL5080910 0.94 ALDH1A1 (0.35) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5082314 0.92 SMN1; SMN2 (0.33) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5081777 0.89 PDK2 (0.33) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5081787 0.87 PDK2 (0.41) KCNQ2CYP3A4ALOX15TSHRPDK2
SCHEMBL5078725 0.86 APEX1 (0.34) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5078671 0.84 APEX1 (0.37) APEX1CYP1A2CYP2C19KMT2AKCNQ2
SCHEMBL5082307 0.83 CYP2C19 (0.36) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5082343 0.83 APEX1 (0.39) APEX1CYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL5078593 0.81 APEX1 (0.37) APEX1CYP1A2KMT2AALDH1A1MAPT
SCHEMBL5084660 0.81 ALDH1A1 (0.33) APEX1CYP1A2CYP2C19KMT2AALDH1A1

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-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-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 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 APEX1 1975/4885CYP1A2 959/4885CYP2C19 588/4885

“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.