SCHEMBL6746767

SCHEMBL6746767

CC(C)O[SiH2]c1ccc2cc3cc4ccccc4cc3cc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HBB P68871 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
UGT2B7 P16662 1/20 0.37
CYP2A6 P11509 3/20 0.36
CYP1A2 P05177 2/20 0.36
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
AOC3 Q16853 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NQO1 P15559 1/20 0.31

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
SCHEMBL6748695 0.77 CYP1A2 (0.42) TDP1ALDH1A1CYP3A4HSD17B10CYP1A2
SCHEMBL6749572 0.76 TDP1 (0.36) TDP1ALDH1A1CYP3A4ALOX15CASP1
SCHEMBL6744741 0.75 NQO1 (0.35) ALDH1A1CYP3A4CASP1HIF1AHSD17B10
SCHEMBL2959747 0.74 CA12 (0.30) CA1CA2
SCHEMBL6751513 0.74 KIF11 (0.31)
SCHEMBL27978334 0.74 CYP2A6 (0.50) TDP1ALDH1A1CYP3A4HSD17B10UGT2B7
SCHEMBL676009 0.73
SCHEMBL10516155 0.73 ALDH1A1 (0.44) TDP1ALDH1A1CYP3A4ALOX15CASP1
SCHEMBL707169 0.72 ALDH1A1 (0.37) TDP1ALDH1A1HIF1ACYP2A6
SCHEMBL6751478 0.72 CYP2A6 (0.39) TDP1ALDH1A1CYP3A4ALOX15CASP1

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 TDP1 4084/4885ALDH1A1 460/4885CYP3A4 1707/4885

“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.