SCHEMBL6744738

SCHEMBL6744738

CCO[SiH](OCC)c1cccc2cc3cc4ccccc4cc3cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.39
NR1I2 O75469 1/20 0.36
ALDH1A1 P00352 5/20 0.35
HSD17B10 Q99714 2/20 0.35
HIF1A Q16665 1/20 0.35
CYP1B1 Q16678 1/20 0.35
NQO1 P15559 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HPGD P15428 3/20 0.35
CYP1A2 P05177 3/20 0.35
KDM4E B2RXH2 3/20 0.34
GAA P10253 2/20 0.34
LMNA P02545 1/20 0.33
ERBB2 P04626 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33
AHR P35869 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
CDC25B P30305 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
SCHEMBL6750036 0.87 HTR2A (0.37) HTR2ANR1I2ALDH1A1HSD17B10HIF1A
SCHEMBL15067825 0.86 HPGD (0.40) ALDH1A1HSD17B10HPGDCYP1A2KDM4E
SCHEMBL15848274 0.86 HTR2A (0.33) HTR2ANR1I2ALDH1A1HSD17B10HIF1A
SCHEMBL15669170 0.85 NR1I2 (0.37) HTR2ANR1I2ALDH1A1HSD17B10HIF1A
SCHEMBL6746721 0.80 HTR2A (0.39) HTR2ANR1I2ALDH1A1HSD17B10HIF1A
SCHEMBL16487391 0.80 HPRT1 (0.47) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL27886035 0.79 NQO1 (0.44) HTR2AALDH1A1HSD17B10HIF1ACYP1B1
SCHEMBL19809298 0.79 CNR1 (0.40) ALDH1A1HPGDKDM4ELMNACDC25B
SCHEMBL19809234 0.78 HPGD (0.37) ALDH1A1HPGDCYP1A2KDM4ELMNA
SCHEMBL15847959 0.77 PPARG (0.38) ALDH1A1HPGDKDM4EGAALMNA

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 HTR2A 3124/4885NR1I2 3741/4885ALDH1A1 460/4885

“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.