SCHEMBL6748665

SCHEMBL6748665

CCO[Si](OCC)(OCC)c1c2ccccc2cc2cc3ccccc3cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HIF1A Q16665 1/20 0.35
CYP1B1 Q16678 1/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
HTR2A P28223 1/20 0.35
NQO1 P15559 1/20 0.35
KDM4E B2RXH2 4/20 0.33
NPSR1 Q6W5P4 2/20 0.33
RAB9A P51151 1/20 0.33
BTK Q06187 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 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
SCHEMBL4099237 0.93 NR1I2 (0.40) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL6746731 0.85 NR1I2 (0.35) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL28262655 0.84 CYP1A2 (0.33) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL2352239 0.83 CYP2A6 (0.35) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL6751520 0.81 NQO1 (0.42) ALDH1A1HSD17B10HIF1ACYP1B1L3MBTL1
SCHEMBL1639907 0.80 NR1I2 (0.33) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL8372220 0.80 ALDH1A1 (0.30) ALDH1A1HSD17B10CYP1A2HPGD
SCHEMBL3350607 0.80 GABRP (0.36) ALDH1A1L3MBTL1KDM4ENPSR1RAB9A
SCHEMBL29777530 0.78 NQO1 (0.36) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL935775 0.78 NQO1 (0.36) NR1I2ALDH1A1HSD17B10HIF1ACYP1B1

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 NR1I2 3741/4885ALDH1A1 460/4885HSD17B10 1832/4885

“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.