SCHEMBL29200353

SCHEMBL29200353

NC(=O)c1ccccc1NCc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.73
▸ KMT2A Q03164 6/20 0.73
▸ KDM4E B2RXH2 3/20 0.73
▸ PARP1 P09874 1/20 0.64
▸ NPC1 O15118 3/20 0.57
▸ RAB9A P51151 3/20 0.57
▸ MAPT P10636 5/20 0.57
▸ LMNA P02545 3/20 0.57
▸ HTT P42858 3/20 0.57
▸ MAPK14 Q16539 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ AURKA O14965 4/20 0.56
▸ RPS6KB1 P23443 4/20 0.56
▸ MTOR P42345 1/20 0.53
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PDPK1 O15530 1/20 0.50

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
SCHEMBL30802612 1.00 MEN1 (0.73) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL29200319 0.92 MEN1 (0.75) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL30802613 0.92 MEN1 (0.75) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL29200355 0.88 PARP1 (0.64) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL30802634 0.86 KDM4E (0.77) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL29200337 0.86 KDM4E (0.77) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL29200373 0.86 PARP1 (0.64) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL30802641 0.86 PARP1 (0.64) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL30802622 0.86 PARP1 (0.64) MEN1KMT2AKDM4EPARP1NPC1
SCHEMBL30802620 0.86 PARP1 (0.85) MEN1KMT2AKDM4EPARP1NPC1

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-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 — — CN claimed
CN-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 — — CN disclosed
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