SCHEMBL4131674

SCHEMBL4131674

C=COc1ccc(C2(c3ccc(OC=C)c(OCC)c3OCC)c3ccccc3-c3ccccc32)c(OCC)c1OCC

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.36
CYP3A4 P08684 1/20 0.31
PTPRC P08575 1/20 0.31
CDC25B P30305 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL4140236 0.90 PDK2 (0.36) PDK2
SCHEMBL4136981 0.82 PARP1 (0.33) PDK2KDM4ESMN1; SMN2
SCHEMBL4131212 0.82 PDK2 (0.34) PDK2CYP3A4PTPRCL3MBTL1KDM4E
SCHEMBL29720841 0.81 THRB (0.40) PDK2L3MBTL1HPGD
SCHEMBL556302 0.81 THRB (0.40) PDK2L3MBTL1HPGD
SCHEMBL4137298 0.78 PDK2 (0.35) PDK2
SCHEMBL31068446 0.77 PDK2 (0.36) PDK2CYP3A4PTPRCCDC25BL3MBTL1
SCHEMBL4140244 0.77 L3MBTL1 (0.34) PDK2PTPRCL3MBTL1KDM4EHPGD
SCHEMBL2873370 0.77 PDK2 (0.36) PDK2CYP3A4PTPRCCDC25BL3MBTL1
SCHEMBL4143803 0.76 PDK2 (0.35) PDK2KDM4EHPGDSMN1; SMN2NPSR1

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
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 claimed
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