SCHEMBL3296342

SCHEMBL3296342

COc1cc(OC)cc([SiH](O[SiH](c2ccccc2)c2cc(OC)cc(OC)c2)c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.44
ALDH1A1 P00352 4/20 0.44
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A1 P04798 1/20 0.41
CYP2E1 P05181 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP4B1 P13584 1/20 0.41
CYP2B6 P20813 1/20 0.41
CYP3A5 P20815 1/20 0.41
CYP2A7 P20853 1/20 0.41
CYP3A7 P24462 1/20 0.41
CYP2F1 P24903 1/20 0.41
CYP2C18 P33260 1/20 0.41
CYP2C19 P33261 1/20 0.41
CYP2J2 P51589 1/20 0.41
CYP4F2 P78329 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
SCHEMBL3302339 0.89 ACHE (0.41) CA4ALDH1A1CYP1A2CYP2A6CYP3A4
SCHEMBL3299269 0.87 ALDH1A1 (0.58) ALDH1A1CYP1A2CYP2A6CYP3A4CYP1A1
SCHEMBL3299381 0.86 CA4 (0.48) CA4ALDH1A1CYP1A2CYP2A6CYP3A4
SCHEMBL3295781 0.83 CA4 (0.54) CA4ALDH1A1CYP1A2CYP2A6CYP2C19
SCHEMBL27949684 0.79 CA4 (0.48) CA4ALDH1A1CYP1A2CYP2A6CYP3A4
SCHEMBL3294227 0.79 ACHE (0.50) CA4ALDH1A1CYP1A2CYP2A6CYP3A4
SCHEMBL308706 0.78 TSHR (0.35) CA4ALDH1A1LTA4HTSHRLMNA
SCHEMBL3293280 0.75 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP2A6CYP3A4CYP1A1
SCHEMBL16178636 0.75 TSHR (0.33) CA4ALDH1A1LTA4HTSHR
SCHEMBL3296208 0.74 CA12 (0.47) ALDH1A1CYP1A2CYP2A6CYP1A1CYP1B1

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 CA4 1301/4885ALDH1A1 1865/4885CYP1A2 945/4885

“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.