SCHEMBL5774858

SCHEMBL5774858

C=C[Si](C)(C=C)c1ccccc1[Si](C)(C=C)C=C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TSHR P16473 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
SCHEMBL29214137 0.84 ACHE (0.36)
SCHEMBL7630667 0.80 LMNA (0.46) ALDH1A1TSHR
SCHEMBL29214153 0.79 HSD11B1 (0.37) ALDH1A1
SCHEMBL7630661 0.79
SCHEMBL3094174 0.78 NR1H2 (0.36) HDAC8ALDH1A1TSHR
SCHEMBL160355 0.76 ESR1 (0.39) HDAC8ALDH1A1TSHR
SCHEMBL5771954 0.71 NR1H2 (0.39)
SCHEMBL5774443 0.71 ALDH1A1 (0.36) HDAC8ALDH1A1TSHR
SCHEMBL9634722 0.70 TSHR (0.39) HDAC8ALDH1A1TSHR
SCHEMBL2558125 0.69 ALDH1A1 (0.38) ALDH1A1TSHR

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-20060134336-A1 Novel polycarbosilane and method of producing the same, film-forming composition, and film and method of forming the same JSR CORPORATION (JP) 2006-06-22 US disclosed
EP-1661934-A1 Polycarbosilane and method of producing the same, film-forming composition, and film and method of forming the same JSR Corporation (JP) 2006-05-31 EP disclosed