SCHEMBL24899358

SCHEMBL24899358

CC(C)(C)OC(=O)[C@H](Cc1cccc2ccncc12)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 2/20 0.46
TP53 P04637 2/20 0.46
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
MDM2 Q00987 1/20 0.43
CYP3A4 P08684 2/20 0.42
ROCK2 O75116 2/20 0.41
SLC17A5 Q9NRA2 1/20 0.40
CASP3 P42574 1/20 0.40

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
SCHEMBL30229501 1.00 MDM4 (0.46) MDM4TP53CTSSCTSKMDM2
SCHEMBL24899359 1.00 MDM4 (0.46) MDM4TP53CTSSCTSKMDM2
SCHEMBL24915806 0.89 MDM4 (0.50) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL30229636 0.89 MDM4 (0.50) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL30229510 0.89 MDM4 (0.50) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL29221380 0.89 MDM4 (0.50) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL24899402 0.85 MDM4 (0.46) MDM4TP53CTSSCTSKMDM2
SCHEMBL30229631 0.85 MDM4 (0.46) MDM4TP53CTSSCTSKMDM2
SCHEMBL24899400 0.85 MDM4 (0.46) MDM4TP53CTSSCTSKMDM2
SCHEMBL29530184 0.83 MDM4 (0.44) MDM4TP53MDM2ROCK2CASP3

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 5 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-2023004240-A1 MACROCYLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-26 WO disclosed
WO-2023288213-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-19 WO disclosed