SCHEMBL3294227

SCHEMBL3294227

COc1cccc([SiH](O[SiH](c2cccc(OC)c2)c2cccc(OC)c2)c2cccc(OC)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
ENPP2 Q13822 1/20 0.44
CHRM5 P08912 1/20 0.42
CA4 P22748 1/20 0.42
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PARP1 P09874 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL3299381 0.94 CA4 (0.48) ACHECA1CA2CA7CA9
SCHEMBL25008080 0.82 ACHE (0.54) ACHECA1CA2CA7CA9
SCHEMBL27452685 0.80 ACHE (0.52) ACHECA1CA2CA7CA9
SCHEMBL3296342 0.79 CA4 (0.44) ALDH1A1CYP3A4CA4NPC1RAB9A
SCHEMBL3297734 0.78 TP53 (0.53) ALDH1A1CYP3A4SMN1; SMN2CYP1A2
SCHEMBL3296936 0.78 KIF11 (0.38) ALDH1A1
SCHEMBL3299967 0.77 LTA4H (0.50) ALDH1A1SMN1; SMN2
SCHEMBL28088787 0.77 CA4 (0.52) ACHECA1CA2CA7CA9
SCHEMBL3299269 0.77 ALDH1A1 (0.58) CA1CA2CA7CA9ALDH1A1
1,3-Dimethoxybenzene SCHEMBL901285 0.75 ACHE (0.70) ACHECA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741393-B2 Organic silicon-based compound and method of producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-22 US disclosed
US-20070203275-A1 Organic Silicon-Based Compound And Method Of Producing The Same SUMITOMO CHEMICAL COMPANY, LIMITED 2007-08-30 US 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-20070203275-A1 Organic Silicon-Based Compound And Method Of Producing The Same ARSA, OR10J3, HDAC10 ACHE 3477/4885CA1 2428/4885CA2 3413/4885

“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.