SCHEMBL25754017

SCHEMBL25754017

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 5/20 0.48
MALT1 Q9UDY8 2/20 0.43
CYP19A1 P11511 1/20 0.41
MEN1 O00255 1/20 0.38
NSD2 O96028 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPN1 P18031 1/20 0.37
HPGD P15428 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
IDO1 P14902 1/20 0.36
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
PTPN13 Q12923 1/20 0.35
TLR2 O60603 1/20 0.35
TLR1 Q15399 1/20 0.35
RECQL P46063 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PKM P14618 2/20 0.35

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
SCHEMBL25754024 0.83 CDC25A (0.43) PTPRCMALT1CYP19A1PTPN1HPGD
SCHEMBL21939833 0.81 PTPRC (0.49) PTPRCMALT1MEN1KMT2AL3MBTL1
SCHEMBL4124507 0.80 MALT1 (0.60) MALT1CYP19A1MEN1KMT2AIDO1
SCHEMBL25754015 0.78 ALDH1A1 (0.44) MALT1CYP19A1L3MBTL1PTPN1HPGD
SCHEMBL21878875 0.78 ACE (0.48)
SCHEMBL21878873 0.78 ACE (0.48)
SCHEMBL30692084 0.78 ACE (0.48)
SCHEMBL4105352 0.77 MALT1 (0.62) PTPRCMALT1CYP19A1MEN1NSD2
SCHEMBL25753950 0.76 PTPRC (0.47) PTPRCMALT1L3MBTL1PTPN13TLR2
SCHEMBL13649364 0.74 MALT1 (0.58) PTPRCMALT1CYP19A1MEN1NSD2

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