SCHEMBL29682425

SCHEMBL29682425

NC(=O)CCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.56
TP53 P04637 3/20 0.56
TLR2 O60603 2/20 0.55
MDM2 Q00987 6/20 0.52
KMT2A Q03164 2/20 0.51
CASP3 P42574 2/20 0.51
SLC17A5 Q9NRA2 1/20 0.49
PTPN1 P18031 1/20 0.49

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
SCHEMBL800090 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL5182292 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL119475 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL29352431 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL29908079 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL29401101 1.00 MDM4 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL27435787 0.94 MDM2 (0.56) MDM4TP53TLR2MDM2KMT2A
SCHEMBL29694496 0.93 PTPN1 (0.58) MDM4TP53TLR2MDM2KMT2A
SCHEMBL30929979 0.92 TLR2 (0.49) MDM4TP53TLR2MDM2KMT2A
SCHEMBL30255589 0.92 TLR2 (0.49) MDM4TP53TLR2MDM2KMT2A

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
CN-114760995-A Composition for preventing, alleviating or treating respiratory diseases 微艾克斯有限公司 2022-07-15 CN disclosed