SCHEMBL4131087

SCHEMBL4131087

C=COc1c(OCC)cc(C2(c3cc(OCC)c(OC=C)c(CCC)c3OCC)c3ccccc3-c3ccccc32)c(OCC)c1CCC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.34
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL4143803 0.91 PDK2 (0.35) PDK2KDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL4123427 0.90 PDK2 (0.37) PDK2
SCHEMBL4131212 0.87 PDK2 (0.34) PDK2KDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL4140244 0.85 L3MBTL1 (0.34) PDK2KDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL4141396 0.82 PDK2 (0.37) PDK2
SCHEMBL4128524 0.81 PDK2 (0.30) PDK2
SCHEMBL6323480 0.80 TSHR (0.33) PDK2KDM4E
SCHEMBL28295326 0.79 L3MBTL1 (0.33) PDK2
SCHEMBL4140147 0.78 PDK2 (0.37) PDK2
SCHEMBL4125740 0.76 PDK2 (0.36) 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