SCHEMBL5000632

SCHEMBL5000632

C=C(CCC(C)O[Si](C)(C)C)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 3/20 0.31
TET3 O43151 1/20 0.31
TET1 Q8NFU7 1/20 0.31
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM2 Q14416 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
SCHEMBL27854745 0.80 GABRP (0.46) TET2TET3GRIK1GRIK2GRM1
SCHEMBL338900 0.79 TET2 (0.34) TET2TET3TET1GRIK1GRIK2
SCHEMBL5000684 0.77 LMNA (0.30)
SCHEMBL8752403 0.77 TET2 (0.33) TET2TET3TET1GRIK1GRIK2
SCHEMBL27792 0.76 ALDH1A1 (0.45) TET2TET3TET1GRIK1GRIK2
SCHEMBL828545 0.76 GABRP (0.33) TET2TET3TET1GRIK1GRIK2
SCHEMBL4446236 0.74 LMNA (0.44) TET2TET3TET1GRIK1GRIK2
SCHEMBL2113464 0.74 ALOX15 (0.34) TET2TET3TET1GRIK1GRIK2
Hydrochloric Acid SCHEMBL1961274 0.74 ALDH1A1 (0.43) TET2TET3TET1GRIK1GRIK2
SCHEMBL23251 0.73 CA1 (0.48) TET2TET3TET1GRIK1GRIK2

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-7417090-B2 Water-dispersible polyisocyanate composition, production thereof, and water-based curable composition and application thereof DAINIPPON INK & CHEMICALS, INC. (JP) 2008-08-26 US disclosed
US-20070049691-A1 Water-dispersible polyisocyanate composition, production thereof, and water-based curable composition and application thereof DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-03-01 US disclosed