SCHEMBL9645772

SCHEMBL9645772

C=COc1ccccc1.[SiH3]O[SiH3]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.36
CA4 P22748 1/20 0.36
THRB P10828 1/20 0.33
KCNA3 P22001 1/20 0.33
TGM2 P21980 1/20 0.32
CA5A P35218 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
NR1H2 P55055 1/20 0.31
BAX Q07812 1/20 0.31
MAOA P21397 1/20 0.31
PAX8 Q06710 1/20 0.31
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
AOC3 Q16853 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL35471 0.92
Benzene SCHEMBL28860269 0.92 LTA4H (0.45) LTA4HTSHRALDH1A1CA4THRB
SCHEMBL9809350 0.90 LTA4H (0.39) LTA4HTSHRALDH1A1CA4THRB
SCHEMBL28675765 0.90 LTA4H (0.43) LTA4HTSHRALDH1A1CA4THRB
Methane SCHEMBL272168 0.90 LTA4H (0.43) LTA4HTSHRALDH1A1CA4THRB
Water SCHEMBL28321219 0.90 LTA4H (0.43) LTA4HTSHRALDH1A1CA4THRB
Water SCHEMBL27492848 0.90 LTA4H (0.43) LTA4HTSHRALDH1A1CA4THRB
Butadiene SCHEMBL9484267 0.87 LTA4H (0.41) LTA4HTSHRALDH1A1CA4THRB
Vinyl Ether SCHEMBL1412708 0.85 TSHR (0.39) LTA4HTSHRALDH1A1CA4THRB
Vinyl Chloride SCHEMBL9714994 0.85 LTA4H (0.39) LTA4HTSHRALDH1A1CA4THRB

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-5157094-A Aromatic vinyl ether siloxanes ISP INVESTMENTS INC. (US) 1992-10-20 US disclosed
US-5156897-A Aromatic vinyl ether siloxanes ISP INVESTMENTS INC. (US) 1992-10-20 US disclosed