SCHEMBL11897451

SCHEMBL11897451

C=CC(CC(=O)O)N(C)[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
BLM P54132 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MEN1 O00255 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC22A6 Q4U2R8 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
SCHEMBL10357733 0.79 SLC22A6 (0.35) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL1481043 0.79
SCHEMBL12813988 0.78
SCHEMBL11897682 0.74 GRIK1 (0.30)
SCHEMBL1478099 0.72
SCHEMBL21670755 0.67 SLC22A6 (0.35) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL1583283 0.67 GRIK1 (0.36) CYP2C19
SCHEMBL614363 0.63
SCHEMBL8147302 0.63
SCHEMBL27200152 0.63 SLC6A2 (0.31) SLC6A2SLC6A4BLMSLC6A3MEN1

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
EP-2483317-A1 FUNCTIONALIZED POLYMERS AND METHODS FOR THEIR MANUFACTURE Bridgestone Corporation (JP) 2012-08-08 EP disclosed