SCHEMBL534211

SCHEMBL534211

C=C(C)C(=O)C(=O)CCOc1ccc(C2(c3ccc(OCCC(=O)C(=O)C(=C)C)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 18/20 0.41
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
OPRK1 P41145 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL535058 0.94 PDK2 (0.43) PDK2
SCHEMBL3760944 0.93 PDK2 (0.41) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL534499 0.88 MAPT (0.39) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL16425349 0.82 MAPT (0.41) PDK2MAPTKDM4EMEN1LMNA
Methacrylic Acid SCHEMBL23002863 0.81 GAA (0.46) PDK2MAPTKDM4EMEN1LMNA
Methacrylic Acid SCHEMBL31331565 0.81 GAA (0.46) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL30800968 0.81 POLB (0.48) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL157502 0.81 POLB (0.48) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL2384274 0.81 PDK2 (0.44) PDK2MAPTKDM4EMEN1LMNA
SCHEMBL534807 0.81 POLB (0.53) PDK2MAPTKDM4EMEN1LMNA

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-2415794-A1 CURABLE COMPOSITION AND CURED PRODUCT THEREOF Showa Denko K.K. (JP) 2012-02-08 EP disclosed
US-20120010361-A1 CURABLE COMPOSITION AND CURED PRODUCT THEREOF SHOWA DENKO K.K. (JP) 2012-01-12 US disclosed