SCHEMBL16224070

SCHEMBL16224070

CCC(O)CC(C)COOCC(C)(C)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33

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
SCHEMBL6252835 0.85 ACACB (0.33) ACACBACACA
SCHEMBL6249566 0.72
SCHEMBL28964266 0.66 ACACB (0.45) ACACBACACA
SCHEMBL5850287 0.65 CYP2C9 (0.38) ACACBACACA
SCHEMBL5851756 0.64 CYP2C9 (0.36) ACACBACACA
SCHEMBL475085 0.64 ALDH1A1 (0.39) ACACBACACA
SCHEMBL1362384 0.64 CYP2C9 (0.33) ACACBACACA
SCHEMBL16224071 0.64 ACACB (0.31) ACACBACACA
SCHEMBL16223954 0.64 MAPK1 (0.32)
SCHEMBL4916397 0.64 ACACB (0.33) ACACBACACA

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-1564225-B1 Non-gel hydroxyperoxyester emulsion ARKEMA FRANCE (FR) 2014-11-12 EP claimed