SCHEMBL6744734

SCHEMBL6744734

CO[Si](C)(C)c1cccc2cc3cc4ccccc4cc3cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.41
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 5/20 0.36
GAA P10253 2/20 0.36
CYP1A2 P05177 4/20 0.34
CYP2A6 P11509 1/20 0.34
MAPT P10636 4/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ELANE P08246 1/20 0.33
NQO2 P16083 1/20 0.33
HIF1A Q16665 1/20 0.33
CYP1B1 Q16678 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL3297404 0.84 NQO1 (0.42) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6748539 0.84 NQO1 (0.42) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL12274478 0.81 NQO1 (0.44) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL29503121 0.81 NQO1 (0.44) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL1616108 0.81 NQO1 (0.44) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL6750035 0.81 NQO1 (0.34) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL27665193 0.81 ALDH1A1 (0.40) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL28049648 0.81 ALDH1A1 (0.40) NQO1ALDH1A1KDM4EGAACYP1A2
SCHEMBL15067824 0.81 CYP2A6 (0.41) ALDH1A1KDM4ECYP1A2CYP2A6MAPT
SCHEMBL14600079 0.79 ALDH1A1 (0.41) NQO1ALDH1A1KDM4EGAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696588-B2 OXIDATION POTENTIAL OF .3-1.5 V ON THE BASIS OF A STANDARD HYDROGEN ELECTRODE, ALKOXY AND AROMATIC AMINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-02-24 US disclosed
EP-0861845-B1 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL CO (JP) 2003-05-28 EP disclosed
US-20020115877-A1 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2002-08-22 US disclosed
US-6369258-B1 SILICON COMPOUND WITH OXIDATION POTENTIAL ON HYDROGEN ELECTRODE POTENTIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-04-09 US disclosed
EP-0861845-A2 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-02 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-20020115877-A1 Silicon-containing compound and organic electroluminescence device using the same EPCAM, PIEZO1, OR10J3 NQO1 2288/4885ALDH1A1 460/4885KDM4E 296/4885

“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.