SCHEMBL6707973

SCHEMBL6707973

CCOc1ccc([SiH](C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.67
TSHR P16473 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
LTA4H P09960 2/20 0.50
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PARP10 Q53GL7 1/20 0.45
RELA Q04206 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
PLA2G4B P0C869 1/20 0.44
ADRA2A P08913 2/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL15878867 0.83 NQO1 (0.70) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL9617383 0.82 NQO1 (0.61) NQO1TSHRTDP1LTA4HKDM4E
1,4-Diethoxybenzene SCHEMBL28186701 0.82 NQO1 (1.00) NQO1TSHRTDP1LTA4HKDM4E
1,4-Diethoxybenzene SCHEMBL124015 0.82 NQO1 (1.00) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL3298993 0.79 NQO1 (0.64) NQO1TSHRTDP1LTA4HKDM4E
1,4-Diethoxybenzene SCHEMBL11794798 0.79 NQO1 (0.93) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL8653802 0.77 NQO1 (0.61) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL6055007 0.77 NQO1 (0.37) NQO1TSHRTDP1SMN1; SMN2CA12
SCHEMBL8765008 0.77 NQO1 (0.54) NQO1TSHRTDP1LTA4HKDM4E
1,4-Diethoxybenzene SCHEMBL27616183 0.76 NQO1 (0.88) NQO1TSHRTDP1LTA4HKDM4E

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5139785-A Synergistic mixture of a silane-containing compound and a pesticides; insecticides, miticides and nematocides HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-18 US claimed
JP-4288087-A None JP disclosed
US-8778837-B2 Use of active substance combinations for controlling animal pests BAYER CROPSCIENCE AG (DE) 2014-07-15 US disclosed
US-20140080820-A1 FUNGICIDAL AGENT COMBINATIONS BAYER CROPSCIENCE AG (DE) 2014-03-20 US disclosed
US-20040127363-A1 Pesticidal compositions containing silicon compounds KIDRON AGROCHEM LTD. (IL) 2004-07-01 US disclosed
EP-1370142-A2 PESTICIDAL COMPOSITIONS CONTAINING SILICON COMPOUNDS Kidron Agrochem Ltd (IL) 2003-12-17 EP disclosed
WO-2001067863-A2 PESTICIDAL COMPOSITIONS CONTAINING SILICON COMPOUNDS KIDRON AGROCHEM LTD. (IL) 2001-09-20 WO disclosed
CN-1044661-C Pesticides, insecticides, miticides and nematocides compositions containing new silanes derivatives HOECHST AG (DE) 1999-08-18 CN disclosed
EP-0543238-B1 3-Isoxazolylphenyl-compounds, their preparation and application BASF AG (DE) 1997-06-04 EP disclosed
CN-1032005-C Novel silane derivatives, formulations containing them and their use as pesticides HOECHST AG (DE) 1996-06-12 CN disclosed
EP-0479244-A1 Process for the preparation of 4-ethoxyphenyl-3-arylpropyl-dimethyl silanes Hoechst Schering AgrEvo GmbH (DE) 1992-04-08 EP disclosed
EP-0468373-A1 Process for the preparation of aryl-alkyl-methylsilanes Hoechst Schering AgrEvo GmbH (DE) 1992-01-29 EP disclosed
CN-1050878-A Novel silane derivs contains the preparation of this derivative and as the application of agricultural chemicals HOECHST AG (DE) 1991-04-24 CN disclosed
US-4990621-A Insecticides, miticides and nematocides; 3-(3-fluoro-4-phenoxyphenyl, 3-(5-fluoro-3-phenoxypyrid-2-yl) or 3-(3-methyl-4-phenyl prop-1-ene HOECHST AKTIENGESELLSCHAFT (DE) 1991-02-05 US disclosed
EP-0224024-B1 SILANE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AGENTS CONTAINING THEM AND THEIR USE AS PESTICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-20 EP disclosed
US-4920212-A Process for the preparation of (aryl)-(dimethyl)-(3-(4-fluoro-3-aryloxyphenyl)propyl)silanes HOECHST AKTIENGESELLSCHAFT (DE) 1990-04-24 US disclosed
US-4864027-A INSECTICIDES, NEMATOCIDES, MITICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1989-09-05 US disclosed
EP-0308788-A2 Process for the preparation of (aryl)-(dimethyl)-(3-(4-fluoro-3-aryloxyphenyl)propyl) silanes HOECHST AKTIENGESELLSCHAFT (DE) 1989-03-29 EP disclosed
CN-86107292-A Novel silane derivatives, process for their preparation, formulations containing them and their use as pesticides 1987-07-29 CN disclosed
EP-0224024-A1 Silane derivatives, process for their preparation, agents containing them and their use as pesticides HOECHST AKTIENGESELLSCHAFT (DE) 1987-06-03 EP 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-20140080820-A1 FUNGICIDAL AGENT COMBINATIONS DDT, COXFA4L2, CYP4X1 NQO1 240/4885TSHR 4270/4885TDP1 1774/4885

“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.