SCHEMBL534499

SCHEMBL534499

C=C(C)C(=O)C(=O)COc1ccc(C2(c3ccc(OCC(=O)C(=O)C(=C)C)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
OPRK1 P41145 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR174 Q9BXC1 1/20 0.39
PDK2 Q15119 8/20 0.38
POLB P06746 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL16425349 0.92 MAPT (0.41) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL534211 0.88 PDK2 (0.41) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL13962705 0.88 POLB (0.40) MAPTMEN1KMT2APDK2POLB
SCHEMBL535058 0.86 PDK2 (0.43) PDK2
SCHEMBL6577530 0.84 GPR174 (0.47) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL16900315 0.83 GPR174 (0.34) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL13962696 0.83 POLB (0.36) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL3760944 0.82 PDK2 (0.41) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL13962678 0.82 PDK2 (0.33) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL4953296 0.80 POLB (0.40) MAPTMEN1KMT2ALMNAKDM4E

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