SCHEMBL28680445

SCHEMBL28680445

CC(C)CC(C)[Si](C)(C)OC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.37
SLC7A5 Q01650 1/20 0.37
CACNA2D1 P54289 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
CPA1 P15085 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
LAP3 P28838 2/20 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
SCHEMBL28680205 0.75 RNPEP (0.34) RNPEPSLC7A5CACNA2D1ALDH1A1CACNB3
SCHEMBL22558073 0.74 TP53 (0.32)
SCHEMBL28668640 0.74 CA2 (0.39) SLC1A3SLC1A2
SCHEMBL28660295 0.71 ACE2 (0.44) ALDH1A1
SCHEMBL28656898 0.71 ACE2 (0.44) ALDH1A1
SCHEMBL28891855 0.68 TSHR (0.31) RNPEPSLC7A5
SCHEMBL28667175 0.67
SCHEMBL609300 0.64 RNPEP (0.44) RNPEPSLC7A5CACNA2D1ALDH1A1CACNB3
SCHEMBL28659474 0.63 MMP8 (0.33)
SCHEMBL4100051 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113795963-A Carbonate solvents for non-aqueous electrolytes for metal and metal ion batteries 斯塞法国公司 2021-12-14 CN disclosed