SCHEMBL6746751

SCHEMBL6746751

CCCO[SiH](OCCC)c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
CYP1A1 P04798 2/20 0.38
CYP1B1 Q16678 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TDP1 Q9NUW8 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ERBB2 P04626 1/20 0.34
FYN P06241 1/20 0.34
MAOA P21397 1/20 0.34
ACHE P22303 1/20 0.34
AHR P35869 1/20 0.34
MCHR1 Q99705 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
CYSLTR1 Q9Y271 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
SCHEMBL6751453 0.87 CYP1A2 (0.34) ALDH1A1CYP1A2HPGDHSD17B10KMT2A
SCHEMBL6748691 0.86 CYP1A2 (0.41) ALDH1A1CYP1A1CYP1B1CYP1A2CYP3A4
SCHEMBL6748531 0.81 CYP1A2 (0.41) ALDH1A1CYP1A1CYP1B1CYP1A2CYP3A4
SCHEMBL28455764 0.81 CYP1A2 (0.41) ALDH1A1CYP1A2CYP3A4TDP1KDM4E
SCHEMBL6749568 0.79 CYP1A2 (0.36) ALDH1A1CYP1A2CYP3A4HSD17B10KMT2A
SCHEMBL2950776 0.77 KMT2A (0.37) ALDH1A1HPGDTSHRKMT2AMEN1
SCHEMBL6751480 0.77 ALDH1A1 (0.42) ALDH1A1CYP1A1CYP1B1CYP1A2CYP3A4
SCHEMBL6748382 0.73 CYP1A2 (0.36) ALDH1A1CYP1A2HPGDHSD17B10ERBB2
SCHEMBL704584 0.72 ALDH1A1 (0.35) ALDH1A1HPGDTSHRKMT2AMEN1
SCHEMBL313696 0.71 LMNA (0.44) ALDH1A1CYP3A4HPGDTSHRKMT2A

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 ALDH1A1 460/4885CYP1A1 2104/4885CYP1B1 2293/4885

“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.