SCHEMBL28560731

SCHEMBL28560731

CCCCC(C(=O)ON)=C(CCC)[Si](OC)(OC)OC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
POLB P06746 1/20 0.32
POLA1 P09884 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TP53 P04637 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
SCHEMBL28575080 0.94 POLB (0.40) CES2CES1POLBPOLA1ALDH1A1
SCHEMBL28564014 0.94 POLB (0.40) CES2CES1POLBPOLA1ALDH1A1
SCHEMBL28913391 0.87
SCHEMBL28559249 0.86 ALDH1A1 (0.32) CES2CES1ALDH1A1
SCHEMBL28560914 0.83 CES1 (0.35) CES2CES1POLBPOLA1ALDH1A1
SCHEMBL28566930 0.80 THRB (0.36) CES2CES1ALDH1A1
SCHEMBL28566637 0.80 THRB (0.36) CES2CES1ALDH1A1
SCHEMBL28555036 0.77 FNTA (0.42) CES2CES1POLBPOLA1ALDH1A1
SCHEMBL28554588 0.77 FNTA (0.42) CES2CES1POLBPOLA1ALDH1A1
SCHEMBL28554438 0.74

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-110511672-B Bottom-coating active siloxane composition and preparation method and application thereof 广东普赛达密封粘胶有限公司 2021-05-04 CN disclosed