SCHEMBL7169133

SCHEMBL7169133

CC(O)(CCCc1ccccc1)[Si](C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HDAC3 O15379 1/20 0.41
MAPK1 P28482 1/20 0.41
ADRA1A P35348 1/20 0.41
HDAC4 P56524 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
FDPS P14324 6/20 0.41
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL3804525 0.80 POLB (0.49) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL29281939 0.80 HDAC3 (0.50) HDAC3MAPK1ADRA1AHDAC4SLC6A3
SCHEMBL10538923 0.76 HDAC3 (0.50) HDAC3MAPK1ADRA1AHDAC4SLC6A3
SCHEMBL6685035 0.76 L3MBTL1 (0.48) POLBADRA1ASLC6A3L3MBTL1MEN1
SCHEMBL27782631 0.76 POLB (0.45) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL28351862 0.76 POLB (0.53) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL4557607 0.75 L3MBTL1 (0.48) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL11846515 0.74 POLB (0.44) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL9545400 0.74 POLB (0.44) POLBHDAC3MAPK1ADRA1AHDAC4
SCHEMBL11047843 0.74 L3MBTL1 (0.47) POLBADRA1ASLC6A3L3MBTL1MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534489-B1 Organophosphorus compounds and the use thereof JOMAA PHARMAKA GMBH (DE) 2003-03-18 US disclosed
EP-1133500-B1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF JOMAA PHARMAKA GMBH (DE) 2002-09-11 EP disclosed
EP-1133500-A1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF Jomaa Pharmaka GmbH (DE) 2001-09-19 EP disclosed
WO-2000031085-A1 ORGANOPHOSPHOROUS COMPOUNDS AND THE USE THEREOF JOMAA PHARMAKA GMBH (DE) 2000-06-02 WO disclosed