SCHEMBL28099693

SCHEMBL28099693

CC(=O)Nc1ccc(C(=O)Nc2cc(C(N)=O)ccc2NC(=O)c2ccc(-n3ccccc3=O)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 1.00
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
HDAC1 Q13547 4/20 0.46
HDAC3 O15379 1/20 0.46
HDAC2 Q92769 1/20 0.46
NCOR2 Q9Y618 1/20 0.46

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
SCHEMBL28099683 0.86 F10 (1.00) F10
SCHEMBL28834490 0.86 F10 (0.80) F10HDAC1
SCHEMBL28099689 0.86 F10 (0.82) F10
SCHEMBL28099533 0.85 F10 (0.81) F10HDAC1HDAC3HDAC2
SCHEMBL28099691 0.83 F10 (1.00) F10
SCHEMBL28099685 0.82 F10 (0.79) F10
SCHEMBL28099541 0.82 F10 (0.84) F10
SCHEMBL28099696 0.82 F10 (0.73) F10HDAC1
SCHEMBL28099569 0.82 F10 (1.00) F10
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