SCHEMBL28541196

SCHEMBL28541196

CCCCCCONC(=O)c1ccc(C(N)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.55
HDAC3 O15379 6/20 0.55
HDAC4 P56524 6/20 0.55
HDAC1 Q13547 6/20 0.55
HDAC7 Q8WUI4 6/20 0.55
HDAC2 Q92769 6/20 0.55
HDAC10 Q969S8 6/20 0.55
HDAC11 Q96DB2 6/20 0.55
HDAC8 Q9BY41 6/20 0.55
HDAC9 Q9UKV0 6/20 0.55
HDAC5 Q9UQL6 6/20 0.55
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
SPHK1 Q9NYA1 2/20 0.49
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
MAPK1 P28482 2/20 0.49
APAF1 O14727 1/20 0.49
RGS12 O14924 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
SCHEMBL27853144 0.86 HDAC3 (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL28968193 0.86 HDAC3 (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL28973854 0.86 HDAC3 (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL5145338 0.86 HDAC3 (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL27530055 0.86 HDAC3 (0.67) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL1262591 0.84 HDAC3 (0.64) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL28797730 0.81 HDAC3 (0.48) HDAC6HDAC3HDAC4HDAC1HDAC7
Terephthalamide SCHEMBL28497793 0.81 MEN1 (0.67) HDAC6NPC1RAB9ASMN1; SMN2KMT2A
Terephthalamide SCHEMBL17074059 0.81 MEN1 (0.67) HDAC6NPC1RAB9ASMN1; SMN2KMT2A
Terephthalamide SCHEMBL28398318 0.81 MEN1 (0.67) HDAC6NPC1RAB9ASMN1; SMN2KMT2A

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
CN-112538167-B Alkyl chain modified acylhydrazone bond-linked covalent organic framework material and application thereof in photocatalytic hydrogen peroxide production 福州大学 2021-08-31 CN disclosed
CN-112538167-A Alkyl chain modified acylhydrazone bond-linked covalent organic framework material and application thereof in photocatalytic hydrogen peroxide production 福州大学 2021-03-23 CN disclosed