SCHEMBL29258286

SCHEMBL29258286

O=C(/C=C/c1ccncc1)Nc1ccc(S(=O)(=O)NCc2cccc(Br)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
KDM4E B2RXH2 2/20 0.56
NAMPT P43490 12/20 0.55
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
CYP19A1 P11511 1/20 0.48

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
SCHEMBL30927215 1.00 MEN1 (0.56) MEN1KMT2AKDM4ENAMPTHDAC3
SCHEMBL29258361 0.91 MEN1 (0.56) MEN1KMT2AKDM4ENAMPTHDAC3
SCHEMBL29258100 0.89 NAMPT (0.69) MEN1KMT2ANAMPTMAPT
SCHEMBL30927201 0.89 NAMPT (0.69) MEN1KMT2ANAMPTMAPT
SCHEMBL29258194 0.88 NAMPT (0.68) MEN1KMT2AKDM4ENAMPTMAPT
SCHEMBL30927229 0.88 NAMPT (0.68) MEN1KMT2AKDM4ENAMPTMAPT
SCHEMBL29258225 0.88 NAMPT (0.68) MEN1KMT2ANAMPTMAPT
SCHEMBL30927236 0.88 NAMPT (0.68) MEN1KMT2ANAMPTMAPT
SCHEMBL29258153 0.88 MEN1 (0.62) MEN1KMT2AKDM4ENAMPTMAPT
SCHEMBL30927200 0.87 NAMPT (0.53) MEN1KMT2AKDM4ENAMPT

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-118108664-A NAMPT agonist and preparation method and application thereof 中国人民解放军海军军医大学 2024-05-31 CN claimed
CN-118108664-A NAMPT agonist and preparation method and application thereof 中国人民解放军海军军医大学 2024-05-31 CN disclosed