SCHEMBL4269419

SCHEMBL4269419

O=C(O[SiH](OC(=O)C(F)(F)F)c1ccccc1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 7/20 0.42
▸ HDAC6 Q9UBN7 2/20 0.35
▸ DAO P14920 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NAPRT Q6XQN6 1/20 0.34
▸ KCNN4 O15554 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ FAAH O00519 3/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ CES2 O00748 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ CPA1 P15085 1/20 0.32
▸ SRC P12931 1/20 0.32

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
SCHEMBL4267223 0.84 CES1 (0.42) CES1HDAC6DAOTSHRNAPRT
SCHEMBL7052777 0.81 CES1 (0.39) CES1HDAC6DAOTSHRNAPRT
SCHEMBL4270183 0.80 CYP1A2 (0.38) CES1DAOTSHRNAPRTKCNN4
SCHEMBL204167 0.72 ALDH1A1 (0.42) CES1DAOTSHRNAPRTCES2
SCHEMBL1255890 0.68 ELANE (0.47) CES1HDAC1HDAC2
SCHEMBL4266491 0.68 CES1 (0.42) CES1HDAC6KCNN4HDAC1HDAC2
SCHEMBL1053845 0.68 ELANE (0.43) CES1DAOTSHRNAPRTCES2
SCHEMBL10946374 0.67 ELANE (0.46) CES1HDAC1HDAC2
SCHEMBL28404237 0.66 ELANE (0.47) CES1HDAC6TSHRNAPRTACHE
SCHEMBL1051530 0.65 ACHE (0.41) CES1KCNN4HDAC1HDAC2CES2

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
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