SCHEMBL16638169

SCHEMBL16638169

COC(=O)C(C)CC(CC(Br)C(=O)OC)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.42
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MME P08473 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 1/20 0.33
CA14 Q9ULX7 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
SCHEMBL12190597 0.89 ZDHHC7 (0.40) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL106430 0.88 ZDHHC7 (0.47) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL16638163 0.83 ZDHHC7 (0.43) ZDHHC7CA1CA2SMN1; SMN2
SCHEMBL16638165 0.81 ZDHHC7 (0.50) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL19428729 0.80 CA1 (0.52) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL9609800 0.80 CA1 (0.52) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL12914922 0.80 CA1 (0.52) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL11986003 0.80 CA1 (0.52) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL1415280 0.79 ZDHHC7 (0.54) ZDHHC7CA1CA2MMESMN1; SMN2
SCHEMBL6683720 0.77 ZDHHC7 (0.48) ZDHHC7CA1CA2MMESMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2899215-A1 Method for the processing of a mixture (M), comprising an organic component (A), that comprises at least one halogen carbon bond, and a transition metal component (B) BASF SE (DE) 2015-07-29 EP disclosed
US-9006362-B2 Controlled radical polymerization of (meth)acrylate monomers Henkel IP & Holding GmbH (DE) 2015-04-14 US disclosed