SCHEMBL28099533

SCHEMBL28099533

COc1ccc(C(=O)Nc2cc(C(N)=O)ccc2NC(=O)c2ccc(-n3ccccc3=O)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.81
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL28099569 0.88 F10 (1.00) F10MEN1KMT2A
SCHEMBL28099683 0.86 F10 (1.00) F10
SCHEMBL28099689 0.86 F10 (0.82) F10MEN1KMT2A
SCHEMBL28834490 0.86 F10 (0.80) F10MEN1KMT2AHDAC1NPC1
SCHEMBL28099693 0.85 F10 (1.00) F10HDAC3HDAC1HDAC2
SCHEMBL28099691 0.83 F10 (1.00) F10
SCHEMBL28099541 0.82 F10 (0.84) F10MEN1KMT2A
SCHEMBL28099685 0.82 F10 (0.79) F10
SCHEMBL28099696 0.82 F10 (0.73) F10HDAC1
SCHEMBL28099687 0.81 F10 (0.83) F10

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-105985276-A 3,4-dibenzamido benzamide derivative, preparation method and application thereof 南京中瑞药业有限公司 2016-10-05 CN claimed
CN-105985276-A 3,4-dibenzamido benzamide derivative, preparation method and application thereof 南京中瑞药业有限公司 2016-10-05 CN disclosed