SCHEMBL4128543

SCHEMBL4128543

C=COc1ccc(C2(c3ccc(OC=C)cc3OC(C)OC(O)CC)c3ccccc3-c3ccccc32)c(OC(C)OC(O)CC)c1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 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
SCHEMBL4137420 0.90 PDK2 (0.34) PDK2
SCHEMBL4128546 0.84 PDK2 (0.33) PDK2
SCHEMBL4137418 0.79 LMNA (0.38) PDK2
SCHEMBL4128540 0.75 PDK2 (0.34) PDK2
SCHEMBL4135411 0.72
SCHEMBL25434897 0.65 ESR1 (0.44) PDK2
SCHEMBL4135413 0.63 LMNA (0.35) PDK2
SCHEMBL16137527 0.63 ESR1 (0.42) PDK2
SCHEMBL2783179 0.63 PDK2 (0.37) PDK2
SCHEMBL4140226 0.63 MEN1 (0.52) PDK2

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-20090068569-A1 Resin composition for hologram recording material, hologram recording material, and method for producing hologram recording medium NIPPON PAINT CO., LTD. 2009-03-12 US disclosed