SCHEMBL5481210

SCHEMBL5481210

C=C(C(=O)O)C(OCC)(OCC)OCC.O=c1[nH]c(=O)[nH]c(=O)[nH]1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 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
SCHEMBL5051057 0.87 TET2 (0.31)
SCHEMBL1825226 0.75
SCHEMBL9290995 0.72 MAPT (0.38) SMN1; SMN2
SCHEMBL2696605 0.69 TET2 (0.34)
SCHEMBL9303139 0.69 TET2 (0.34)
SCHEMBL9856337 0.69 TET2 (0.34) SMN1; SMN2
SCHEMBL21758270 0.68 ALDH1A1 (0.47) SMN1; SMN2
SCHEMBL2545930 0.67
Methacrylic Acid SCHEMBL546828 0.67 TYMP (0.41) SMN1; SMN2
Methacrylic Acid SCHEMBL251193 0.67 TYMP (0.41) SMN1; SMN2

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
US-20070197688-A1 Masterbatch Composition, Rubber Composition Containing The Same, And Valucanizate ZEON CORPORATION (JP) 2007-08-23 US disclosed