SCHEMBL30988971

SCHEMBL30988971

[2H]OC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.54
TP53 P04637 3/20 0.54
TLR2 O60603 2/20 0.54
CASP3 P42574 2/20 0.52
KMT2A Q03164 1/20 0.51
MDM2 Q00987 6/20 0.51
SLC17A5 Q9NRA2 1/20 0.48
PTPN1 P18031 1/20 0.47

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
SCHEMBL31297461 1.00 MDM4 (0.54) MDM4TP53TLR2CASP3KMT2A
SCHEMBL30549389 1.00 MDM4 (0.54) MDM4TP53TLR2CASP3KMT2A
SCHEMBL29908078 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL29354378 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL1025352 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL29400089 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL30338216 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL14997839 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
SCHEMBL12254866 0.93 KMT2A (0.58) MDM4TP53TLR2CASP3KMT2A
D-Glutamate SCHEMBL28574794 0.89 MDM4 (0.52) MDM4TP53TLR2CASP3KMT2A

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
WO-2024097744-A2 DNA-COMPATIBLE WITTIG OLEFINATION OF ON-DNA PEPTIDYL-YLIDES FOR DEVELOPMENT OF ON-DNA PEPTIDOMIMETICS THROUGH DIVERSITY-ORIENTED SYNTHESIS (DOS) THE ROCKEFELLER UNIVERSITY (US) 2024-05-10 WO disclosed