SCHEMBL23922657

SCHEMBL23922657

CC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.48
KMT2A Q03164 2/20 0.47
PAX8 Q06710 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ATM Q13315 1/20 0.46
TLR2 O60603 1/20 0.45
TLR1 Q15399 1/20 0.45
PTPN1 P18031 2/20 0.43
REN P00797 2/20 0.43
PSMB8 P28062 1/20 0.43
PSMB9 P28065 1/20 0.43
PSMB5 P28074 1/20 0.43

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
SCHEMBL30193352 1.00 MDM2 (0.48) MDM2KMT2APAX8TDP1ATM
SCHEMBL30193482 1.00 MDM2 (0.48) MDM2KMT2APAX8TDP1ATM
SCHEMBL16870092 1.00 MDM2 (0.48) MDM2KMT2APAX8TDP1ATM
SCHEMBL18421240 0.95 MDM2 (0.52) MDM2KMT2APAX8TDP1TLR2
SCHEMBL30193389 0.95 MDM2 (0.52) MDM2KMT2APAX8TDP1TLR2
SCHEMBL16870156 0.95 MDM2 (0.52) MDM2KMT2APAX8TDP1TLR2
SCHEMBL30193403 0.95 MDM2 (0.52) MDM2KMT2APAX8TDP1TLR2
SCHEMBL16870002 0.95 MDM2 (0.52) MDM2KMT2APAX8TDP1TLR2
SCHEMBL29431191 0.92 MDM2 (0.51) MDM2KMT2APAX8TDP1TLR2
SCHEMBL1755616 0.90 PAX8 (0.55) MDM2KMT2APAX8TDP1TLR2

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-3087091-B1 VAR2CSA-DRUG CONJUGATES ZYMEWORKS INC (CA) 2021-10-20 EP disclosed