SCHEMBL3299754

SCHEMBL3299754

COc1c([SiH](O[SiH](c2cccc(C(C)(C)C)c2OC)c2cccc(C(C)(C)C)c2OC)c2cccc(C(C)(C)C)c2OC)cccc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.38
NR1H4 Q96RI1 1/20 0.35
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TNFRSF1A P19438 1/20 0.31
NLRP3 Q96P20 1/20 0.30

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
SCHEMBL3679277 0.83 CA2 (0.39) CA2NR1H4GABRA1GABRB2ALDH1A1
SCHEMBL3298793 0.81 NLRP3 (0.36) CA2GABRA1GABRB2ALDH1A1KDM4E
SCHEMBL3096012 0.80 CA2 (0.50) CA2NR1H4GABRA1GABRB2ALDH1A1
SCHEMBL3298464 0.78 ALDH1A1 (0.43) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL30921753 0.78 CA2 (0.48) CA2NR1H4GABRA1GABRB2ALDH1A1
SCHEMBL3296752 0.77 ALDH1A1 (0.39) CA2ALDH1A1KDM4ESMN1; SMN2NLRP3
SCHEMBL3298138 0.77 CA2 (0.40) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL3299989 0.75 ALDH1A1 (0.34) CA2ALDH1A1TSHRKDM4EMAPK1
SCHEMBL3295228 0.75 SMN1; SMN2 (0.45) CA2ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL6677826 0.72 CA2 (0.43) CA2NR1H4GABRA1GABRB2ALDH1A1

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 CA2 3413/4885NR1H4 3992/4885GABRA1 4115/4885

“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.