SCHEMBL779725

SCHEMBL779725

Cc1cccc(C(=O)P(=O)(C(=O)c2cccc(C)c2)C(=O)c2cccc(C)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
PARP1 P09874 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.56
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
KCNK3 O14649 2/20 0.55
KCNK9 Q9NPC2 2/20 0.55
KCNH2 Q12809 1/20 0.55
HPGD P15428 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
POLB P06746 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MAPT P10636 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
NT5E P21589 1/20 0.49

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
SCHEMBL11047948 0.86 HDAC8 (0.58) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL778171 0.86 HDAC8 (0.58) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL777386 0.81 HDAC8 (0.53) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL777606 0.80 HPGD (0.56) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL781096 0.78 HDAC8 (0.50) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL778580 0.78 HDAC8 (0.50) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL29503529 0.78 PARP1 (0.68) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL186545 0.78 PARP1 (0.68) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL3753879 0.78 PARP1 (0.68) HDAC8HDAC6PARP1SMN1; SMN2MEN1
SCHEMBL779854 0.77 HPGD (0.53) HDAC8HDAC6PARP1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023136027-A1 FLUORINATED PHTHALOCYANINE COMPOUND, COLORING COMPOSITION, AND INKJET INK 富士フイルム株式会社 2023-07-20 WO disclosed
WO-2023090221-A1 FLUORINATED PHTHALOCYANINE COMPOUND, COLORING COMPOSITION, AND INKJET INK 富士フイルム株式会社 2023-05-25 WO disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed