SCHEMBL25754024

SCHEMBL25754024

O=C(O)CNC(=O)CCCC1=CC(=O)c2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.43
CDC25B P30305 3/20 0.43
MAP2K7 O14733 2/20 0.43
S100A4 P26447 1/20 0.43
PTPRC P08575 2/20 0.42
CTSL P07711 1/20 0.42
PTPN13 Q12923 1/20 0.42
KEAP1 Q14145 1/20 0.42
HPGD P15428 1/20 0.41
MALT1 Q9UDY8 1/20 0.41
CYP19A1 P11511 1/20 0.40
LMNA P02545 2/20 0.39
PKM P14618 1/20 0.39
PTPN1 P18031 2/20 0.39
TDP2 O95551 1/20 0.39
G6PD P11413 1/20 0.39
PAX8 Q06710 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PARK7 Q99497 1/20 0.38

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
SCHEMBL21878874 0.84 CDC25A (0.54) CDC25ACDC25BMAP2K7S100A4CYP19A1
SCHEMBL30692083 0.84 CDC25A (0.54) CDC25ACDC25BMAP2K7S100A4CYP19A1
SCHEMBL25754015 0.84 ALDH1A1 (0.44) CDC25AS100A4HPGDMALT1CYP19A1
SCHEMBL25754017 0.83 PTPRC (0.48) CDC25ACDC25BPTPRCPTPN13HPGD
SCHEMBL21939613 0.79 TRPV1 (0.50) MALT1LMNAPKMHDAC6
SCHEMBL28109252 0.79 MAPT (0.51) CDC25ACDC25BMAP2K7S100A4CYP19A1
SCHEMBL6535771 0.78 CDC25A (0.56) CDC25ACDC25BMAP2K7S100A4KEAP1
SCHEMBL21939610 0.77 FAAH (0.48)
SCHEMBL25753852 0.76 LMNA (0.48) CDC25ACDC25BMAP2K7S100A4PTPRC
SCHEMBL21939957 0.76 PARP1 (0.47) HPGDPTPN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615502-B1 THERAPEUTIC COMPOUNDS AND METHODS UNIV TASMANIA (AU) 2023-06-21 EP disclosed