SCHEMBL4274822

SCHEMBL4274822

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

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.43
ACHE P22303 1/20 0.37
KCNN4 O15554 1/20 0.35
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 1/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HDAC6 Q9UBN7 2/20 0.34
FAAH O00519 2/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PTPN1 P18031 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
SCHEMBL4281419 0.86 CES1 (0.42) CES1ACHEKCNN4NR1H2NR1H3
SCHEMBL1053099 0.86 CES1 (0.42) CES1ACHEKCNN4NR1H2NR1H3
SCHEMBL1051530 0.82 ACHE (0.41) CES1ACHEKCNN4NR1H2NR1H3
SCHEMBL4273955 0.82 ACHE (0.41) CES1ACHEKCNN4NR1H2NR1H3
SCHEMBL4266443 0.82 CYP1A2 (0.38) CES1KCNN4MAPTALDH1A1SMN1; SMN2
SCHEMBL15796967 0.80 CES1 (0.37) CES1ACHEKCNN4NR1H2NR1H3
SCHEMBL21399435 0.80 CES1 (0.37) CES1ACHENR1H2NR1H3HDAC1
SCHEMBL21399178 0.78 CES1 (0.36) CES1ACHENR1H2NR1H3HDAC1
SCHEMBL28422623 0.78 LMNA (0.37) CES1MAPTALDH1A1SMN1; SMN2ESR1
SCHEMBL704476 0.77 CES2 (0.41) CES1MAPTALDH1A1SMN1; SMN2ESR1

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-7604866-B2 Comprising silica particles and at least one binder compound; good mechanical strength and abrasion resistance ASAHI KASEI KABUSHIKI KAISHA (JP) 2009-10-20 US disclosed
US-20060269724-A1 Comprising silica particles and at least one binder compound; good mechanical strength and abrasion resistance ASAHI KASEI KABUSHIKI KAISHA (JP) 2006-11-30 US disclosed