SCHEMBL7858656

SCHEMBL7858656

C=Cc1ccc([Si](C)(C)OC(C)=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 1/20 0.36
TAS1R3 Q7RTX0 2/20 0.33
TAS1R1 Q7RTX1 2/20 0.33
TRPA1 O75762 1/20 0.33
HDAC8 Q9BY41 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
TTR P02766 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL706767 0.84 HPGD (0.38) ALDH1A1TSHRLMNAMAPT
SCHEMBL19548017 0.84 ALDH1A1 (0.41) ALDH1A1TDP1TAS1R3TAS1R1TRPA1
SCHEMBL7858560 0.80 TP53 (0.41) ALDH1A1TDP1TRPA1TSHRMEN1
SCHEMBL475950 0.77 LMNA (0.47) ALDH1A1TDP1MEN1LMNAMAPT
SCHEMBL25266761 0.77 ALDH1A1 (0.50) ALDH1A1TDP1TRPA1HDAC8TSHR
SCHEMBL475969 0.75 MAPT (0.43) ALDH1A1TDP1TSHRKDM4ECYP3A4
SCHEMBL2770905 0.75 ALDH1A1 (0.48) ALDH1A1TDP1TAS1R3TAS1R1TRPA1
SCHEMBL21522355 0.74 LMNA (0.53) ALDH1A1TDP1TSHRKDM4EMEN1
SCHEMBL5958178 0.73 ALDH1A1 (0.46) ALDH1A1TDP1TRPA1HDAC8TSHR
SCHEMBL4874392 0.72 ALDH1A1 (0.44) ALDH1A1TDP1TRPA1HDAC8TSHR

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
US-6307081-B1 MACROMONOMER HAS ONE OR MORE SILICON-BONDED HYDROGEN ATOMS AT ONE MOLECULAR CHAIN TERMINAL, AND ONE OR MORE ALIPHATICALLY UNSATURATED SILICON-BONDED ORGANIC GROUPS AT THE OTHER MOLECULAR CHAIN TERMINAL. DOW CORNING SILICONE COMPANY, LTD. (JP) 2001-10-23 US disclosed