SCHEMBL12242539

SCHEMBL12242539

C=C(C)C(=O)COC(=O)c1ccc(C#Cc2ccc(/C=C/C(=O)Oc3ccc(OCOC(=O)C(=C)C)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
MAOB P27338 8/20 0.35
MEN1 O00255 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ABCG2 Q9UNQ0 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
SCHEMBL12242537 0.93 KMT2A (0.40) KMT2AKDM4EMAPTTDP1POLB
SCHEMBL12242508 0.83 CASP3 (0.38) KMT2AKDM4ETDP1POLBAPEX1
SCHEMBL12242512 0.83 POLB (0.42) KMT2AMAPTTDP1POLBAPEX1
SCHEMBL12242549 0.81 AKR1C3 (0.34) KMT2AKDM4EMAPTMEN1
SCHEMBL16425352 0.81 MAPT (0.46) KMT2AKDM4EMAPTTDP1POLB
SCHEMBL16425364 0.81 SNCA (0.42) KMT2AMAPTTDP1POLBAPEX1
SCHEMBL13963268 0.80 KMT2A (0.39) KMT2AKDM4EMAPTPOLBMEN1
SCHEMBL12242504 0.79 TDP1 (0.44) KMT2AMAPTTDP1POLBAPEX1
SCHEMBL13963230 0.79 KMT2A (0.36) KMT2AKDM4EMAPTTDP1POLB
SCHEMBL11986155 0.79 MAPT (0.43) KMT2AKDM4EMAPTTDP1POLB

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-8460576-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-06-11 US disclosed
US-20110253936-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-10-20 US disclosed