SCHEMBL24899322

SCHEMBL24899322

CC(C)(C)OC(=O)C(Cc1ccc2ncccc2c1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 2/20 0.44
TP53 P04637 2/20 0.44
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
PTPN1 P18031 4/20 0.42
MDM2 Q00987 1/20 0.42
FCER2 P06734 1/20 0.41

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
SCHEMBL25356314 0.88 MDM4 (0.49) MDM4TP53PTPN1MDM2
SCHEMBL31210307 0.88 MDM4 (0.49) MDM4TP53PTPN1MDM2
SCHEMBL30229488 0.88 MDM4 (0.49) MDM4TP53PTPN1MDM2
SCHEMBL25356318 0.88 MDM4 (0.49) MDM4TP53PTPN1MDM2
SCHEMBL24915788 0.86 MDM4 (0.43) MDM4TP53PTPN1MDM2
SCHEMBL29529376 0.86 CTSB (0.46) MDM4TP53CTSBCTSSCTSK
SCHEMBL26509386 0.84 ROCK2 (0.44) MDM4TP53CTSBCTSSCTSK
SCHEMBL26167007 0.84 ROCK2 (0.44) MDM4TP53CTSBCTSSCTSK
SCHEMBL30229495 0.84 ROCK2 (0.44) MDM4TP53CTSBCTSSCTSK
SCHEMBL26509307 0.84 MDM2 (0.46) MDM4TP53PTPN1MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024059472-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-03-21 WO disclosed
WO-2023192873-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-10-05 WO disclosed
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 WO disclosed
WO-2023288213-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-19 WO disclosed